(3R)-N-(3-acetamidophenyl)-1-(4-methylpyrimidin-2-yl)piperidine-3-carboxamide

Formula:C19H23N5O2 Mutagenic:none Tumorigenic:none Reproductive Effective:low (3R)-N-(3-acetamidophenyl)-1-(4-methylpyrimidin-2-yl)piperidine-3-carboxamide is a drug-like molecule.

MolName	(3R)-N-(3-acetamidophenyl)-1-(4-methylpyrimidin-2-yl)piperidine-3-carboxamide
MolecularFormula	C19H23N5O2
Smiles	CC(Nc1cccc(NC([C@H](CCC2)CN2c2nc(C)ccn2)=O)c1)=O
InChI	InChI=1S/C19H23N5O2/c1-13-8-9-20-19(21-13)24-10-4-5-15(12-24)18(26)23-17-7-3-6-16(11-17)22-14(2)25/h3,6-9,11,15H,4-5,10,12H2,1-2H3,(H,22,25)(H,23,26)/t15-/m1/s1
InChIK	OGAKYZTWVNGVKN-OAHLLOKOSA-N
TotalMolweight	353.425
Molweight	353.425
MonoisotopicMass	353.185175
CLogP	2.0559
CLogS	-3.719
H Acceptors	7
H Donors	2
TotalSurfaceArea	277.82
Relative PSA	0.26812
PolarSurfaceArea	87.22
Druglikeness	4.6499
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.57692
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Amides	2
Aromatic Nitrogens	2
StereoCon	this enantiomer

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