5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one

C9H12N2O — CID 55262975

IUPAC5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one
SMILESN[C@@H](c1ccc(=O)[nH]c1)C1CC1
InChIInChI=1S/C9H12N2O/c10-9(6-1-2-6)7-3-4-8(12)11-5-7/h3-6,9H,1-2,10H2,(H,11,12)/t9-/m1/s1
InChIKeyMPGRJEIOBKDCHV-SECBINFHSA-N
MW164.21 g/mol
LogP0.78
Rot. Bonds2

About 5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one

5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one (PubChem CID 55262975) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one
PubChem CID55262975
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one
SMILESN[C@@H](c1ccc(=O)[nH]c1)C1CC1
InChIInChI=1S/C9H12N2O/c10-9(6-1-2-6)7-3-4-8(12)11-5-7/h3-6,9H,1-2,10H2,(H,11,12)/t9-/m1/s1
InChIKeyMPGRJEIOBKDCHV-SECBINFHSA-N
XLogP0.78
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(1-aminoethyl)-1H-pyridin-2-one;hydrochloride
CID 105435949
(5-chloro-1H-pyrrol-3-yl)-cyclopropylmethanamine
CID 130000802
5-[(1R,2R)-2-amino-1-hydroxy-3-methylbutyl]-1H-pyridin-2-one
CID 131115674
4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol
CID 116941804
4-[(S)-amino(cyclobutyl)methyl]phenol
CID 130741168
4-[(R)-amino(cyclobutyl)methyl]phenol
CID 130780811
4-[(R)-amino(cyclobutyl)methyl]-6-hydroxy-1H-pyridin-2-one
CID 130638199
3-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-4-one
CID 130706241
(4-chlorophenyl)-cyclooctylmethanamine
CID 65018889
4-[amino(cyclopropyl)methyl]benzonitrile
CID 55282712
(R)-cyclohexyl-(4-iodophenyl)methanamine
CID 171202889
(R)-(6-bromo-3-pyridinyl)-cyclopropylmethanamine
CID 131134352

Frequently Asked Questions

What is the IUPAC name of 5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one?
The IUPAC name of 5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one (CID 55262975) is 5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one.
What is the SMILES notation for 5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one?
The canonical SMILES for 5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one is N[C@@H](c1ccc(=O)[nH]c1)C1CC1.
What is the InChIKey of 5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one?
The InChIKey is MPGRJEIOBKDCHV-SECBINFHSA-N. The full InChI is InChI=1S/C9H12N2O/c10-9(6-1-2-6)7-3-4-8(12)11-5-7/h3-6,9H,1-2,10H2,(H,11,12)/t9-/m1/s1.
What are the key properties of 5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one?
5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one has a molecular weight of 164.21 g/mol, XLogP of 0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(R)-amino(cyclopropyl)methyl]-1H-pyridin-2-one is sourced from PubChem (CID 55262975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).