N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

C15H17N3O2 — CID 103806521

IUPACN-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)NCC(N)c2ccccc2)c[nH]1
InChIInChI=1S/C15H17N3O2/c1-10-7-14(19)12(8-17-10)15(20)18-9-13(16)11-5-3-2-4-6-11/h2-8,13H,9,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyQKDCVIJGDMSBTD-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.11
Rot. Bonds4

About N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 103806521) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
PubChem CID103806521
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)NCC(N)c2ccccc2)c[nH]1
InChIInChI=1S/C15H17N3O2/c1-10-7-14(19)12(8-17-10)15(20)18-9-13(16)11-5-3-2-4-6-11/h2-8,13H,9,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyQKDCVIJGDMSBTD-UHFFFAOYSA-N
XLogP1.11
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-hydroxypropyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 103884747
N-(3-amino-2-hydroxy-3-oxopropyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 114152739
6-methyl-4-oxo-N-[(1S)-1-phenylethyl]-1H-pyridine-3-carboxamide
CID 103718004
6-methyl-4-oxo-N-(2-phenoxybutyl)-1H-pyridine-3-carboxamide
CID 75375675
N-(2-amino-2-phenylethyl)-4-bromo-1H-pyrrole-2-carboxamide
CID 63120519
N-(2-hydroxy-3-methylbutyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 103819928
N-(2-amino-2-phenylethyl)-2,5-dimethyl-1-(1-phenylethyl)pyrrole-3-carboxamide
CID 119528404
N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide
CID 63120448
(2-amino-2-phenylethyl)carbamic acid
CID 66941802
6-methyl-4-oxo-N-phenyl-1H-pyridine-3-carboxamide
CID 110856546
N-(2-amino-2-phenylethyl)-2-methylsulfanylbenzamide
CID 79217268
N-(2-hydroxy-3-methoxypropyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 113278446

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide (CID 103806521) is N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide is Cc1cc(=O)c(C(=O)NCC(N)c2ccccc2)c[nH]1.
What is the InChIKey of N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is QKDCVIJGDMSBTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-7-14(19)12(8-17-10)15(20)18-9-13(16)11-5-3-2-4-6-11/h2-8,13H,9,16H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.11, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 103806521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).