Chem N Butyl 4 Hydroxy Piperidine Ncc

Compound 93
  CheckMol                        TMF02:r0:m0
MF=C9H19NO MW=157.26
 11 11  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2947    0.7602   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2828    2.2806   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5894    0.0238   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5776    3.0408   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8842    0.7840   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8723    2.2925   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1670    3.0527   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4617    2.3162   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7564    3.0764   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0512    2.3400   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  1  0  0
  2  4  1  0  1  0  0
  3  5  1  0  1  0  0
  4  6  1  0  1  0  0
  5  7  1  0  1  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  6  7  1  0  1  0  0
M  END

N-Butyl-4-Hydroxy Piperidine

₹ 0.00 0.00

Chemical Name - N-Butyl-4-Hydroxy Piperidine
Mol Weight - 157.256
Smiles - CCCCN(CC1)CCC1O
InChI - RLKMOPWWGZKHOP-UHFFFAOYSA-N
InChIKey - InChI=1S/C9H19NO/c1-2-3-6-10-7-4-9(11)5-8-10/h9,11H,2-8H2,1H3

Property Name	Property Value
Mol Name	N-Butyl-4-Hydroxy Piperidine
Molweight	157.256
Monoisotopic Mass	157.146664
Clogp	1.4604
Clogs	-1.204
H Acceptors	2
H Donors	1
Total Surface Area	137.73
Relative Psa	0.12089
Polar Surface Area	23.47
Druglikeness	3.6308
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.81818
Molecular Flexibility	0.48954
Molecular Complexity	0.57807
Fragments	1
Non H Atoms	11
Non Ch Atoms	2
Electronegative Atoms	2
Rotatable Bonds	3
Rings Closures	1
Small Rings	1
Sp3 Atoms	11
Symmetric Atoms	2
Amines	1
Alkyl Amines	1
Basic Nitrogens	1
Smiles	CCCCN(CC1)CCC1O
InChIKey	InChI=1S/C9H19NO/c1-2-3-6-10-7-4-9(11)5-8-10/h9,11H,2-8H2,1H3
InChI	RLKMOPWWGZKHOP-UHFFFAOYSA-N

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ACETIC ACID FOR HPLC - 1LTR - 1Ltr

N-Butyl-4-Hydroxy Piperidine