N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide

C14H13N3O2 — CID 94572874

IUPACN-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide
SMILESNC(=O)[C@@H](NC(=O)c1ccccn1)c1ccccc1
InChIInChI=1S/C14H13N3O2/c15-13(18)12(10-6-2-1-3-7-10)17-14(19)11-8-4-5-9-16-11/h1-9,12H,(H2,15,18)(H,17,19)/t12-/m0/s1
InChIKeyNNFNVCWXLGVMOX-LBPRGKRZSA-N
MW255.28 g/mol
LogP1.04
Rot. Bonds4

About N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide

N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide (PubChem CID 94572874) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide
PubChem CID94572874
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC NameN-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide
SMILESNC(=O)[C@@H](NC(=O)c1ccccn1)c1ccccc1
InChIInChI=1S/C14H13N3O2/c15-13(18)12(10-6-2-1-3-7-10)17-14(19)11-8-4-5-9-16-11/h1-9,12H,(H2,15,18)(H,17,19)/t12-/m0/s1
InChIKeyNNFNVCWXLGVMOX-LBPRGKRZSA-N
XLogP1.04
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide
CID 102488759
N-[phenyl(pyridin-4-yl)methyl]pyridine-2-carboxamide
CID 47007723
N-[(1R)-2-amino-2-oxo-1-phenylethyl]quinoline-2-carboxamide
CID 51492407
N-(1-phenylpropyl)pyridine-2-carboxamide
CID 5305559
N-(2-amino-2-oxo-1-phenylethyl)-3-pyridin-2-ylprop-2-enamide
CID 103598072
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide
CID 97242872
N-(2-amino-2-oxo-1-phenylethyl)-1-phenyltriazole-4-carboxamide
CID 56811941
2-(chloroamino)-2-phenylacetamide
CID 89152727
N-(2-hydroxy-1,2,2-triphenylethyl)pyridine-2-carboxamide
CID 171976798
N-(2-amino-2-oxo-1-phenylethyl)-1-benzyl-6-oxopyridazine-3-carboxamide
CID 51308720
methyl 2-phenyl-2-(pyrazine-2-carbonylamino)acetate
CID 12580941
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-6-methylpyridine-3-carboxamide
CID 94608879

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide?
The IUPAC name of N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide (CID 94572874) is N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide?
The canonical SMILES for N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide is NC(=O)[C@@H](NC(=O)c1ccccn1)c1ccccc1.
What is the InChIKey of N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide?
The InChIKey is NNFNVCWXLGVMOX-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H13N3O2/c15-13(18)12(10-6-2-1-3-7-10)17-14(19)11-8-4-5-9-16-11/h1-9,12H,(H2,15,18)(H,17,19)/t12-/m0/s1.
What are the key properties of N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide?
N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide has a molecular weight of 255.28 g/mol, XLogP of 1.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide is sourced from PubChem (CID 94572874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).