N-(2-Methoxyethyl)glycinamide--hydrogen chloride (1/1)

CAS Number: 1220037-70-6
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COCCNC(CN)=O.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C5H12N2O2
Molecular Weight
132.162
Drug-likeness
-0.040964
CAS
1220037-70-6
InChI key
SMNDWCIPGZFGMR-UHFFFAOYSA-N
SMILES
COCCNC(CN)=O.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 1220037-70-6
Molecule Name N-(2-Methoxyethyl)glycinamide--hydrogen chloride (1/1)
Molecular Formula HCl.C5H12N2O2
SMILES COCCNC(CN)=O.Cl
InChI InChI=1S/C5H12N2O2.ClH/c1-9-3-2-7-5(8)4-6;/h2-4,6H2,1H3,(H,7,8);1H
InChI Key SMNDWCIPGZFGMR-UHFFFAOYSA-N
CanonicalSyTyLFy 33467260be2da82b
TotalMolweight 168.623
Molecular Weight 132.162
MonoisotopicMass 132.089878
CLogP -1.7624
CLogS 0.059
H Acceptors 4
H Donors 2
TotalSurfaceArea 114.77
Relative PSA 0.43365
PolarSurfaceArea 64.35
Drug-likeness -0.040964
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.88889
Molecula Flexibility 0.71899
Molecular Complexity 0.48648
Fragments 2
Non HAtoms 9
NonCHAtoms 4
Electronegative Atoms 4
Rotatable Bond 4
Sp3Atoms 6
Amides 1
Amines 1
AlkylAmines 1
BasicNitrogens 1

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