N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide

C21H19N3O2 — CID 97242872

IUPACN-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide
SMILESCc1c(C(=O)N[C@@H](C(N)=O)c2ccccc2)cccc1-c1ccccn1
InChIInChI=1S/C21H19N3O2/c1-14-16(18-12-5-6-13-23-18)10-7-11-17(14)21(26)24-19(20(22)25)15-8-3-2-4-9-15/h2-13,19H,1H3,(H2,22,25)(H,24,26)/t19-/m1/s1
InChIKeyUFLWZCQXNMGTGF-LJQANCHMSA-N
MW345.40 g/mol
LogP3.01
Rot. Bonds5

About N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide

N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide (PubChem CID 97242872) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide.

Molecular Properties

Compound NameN-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide
PubChem CID97242872
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC NameN-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide
SMILESCc1c(C(=O)N[C@@H](C(N)=O)c2ccccc2)cccc1-c1ccccn1
InChIInChI=1S/C21H19N3O2/c1-14-16(18-12-5-6-13-23-18)10-7-11-17(14)21(26)24-19(20(22)25)15-8-3-2-4-9-15/h2-13,19H,1H3,(H2,22,25)(H,24,26)/t19-/m1/s1
InChIKeyUFLWZCQXNMGTGF-LJQANCHMSA-N
XLogP3.01
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide
CID 94572874
N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide
CID 109399313
N-(2-amino-1-phenyl-2-sulfanylideneethyl)-3-hydroxy-2-methylbenzamide
CID 82809158
2,2-dimethyl-3-[(2-methyl-3-pyridin-2-ylbenzoyl)amino]propanoic acid
CID 120527980
N-(2-hydroxypentyl)-2-methyl-3-pyridin-2-ylbenzamide
CID 109399496
N-[[2-(hydroxymethyl)phenyl]methyl]-2-methyl-3-pyridin-2-ylbenzamide
CID 109399422
(2S)-2-[(2,3-dimethylbenzoyl)amino]-2-phenylacetic acid
CID 30123282
methyl (2R)-2-[[2-[[(1R)-2-methoxy-2-oxo-1-phenylethyl]carbamoyl]benzoyl]amino]-2-phenylacetate
CID 26791246
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-6-methylpyridine-3-carboxamide
CID 94608879
N-(2-amino-2-oxo-1-phenylethyl)-1H-indazole-7-carboxamide
CID 166189674
N-[(1-methoxycyclobutyl)methyl]-2-methyl-3-pyridin-2-ylbenzamide
CID 136521765
2,3-dimethyl-4-pyridin-2-ylbenzoic acid
CID 175747160

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide?
The IUPAC name of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide (CID 97242872) is N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide.
What is the SMILES notation for N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide?
The canonical SMILES for N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide is Cc1c(C(=O)N[C@@H](C(N)=O)c2ccccc2)cccc1-c1ccccn1.
What is the InChIKey of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide?
The InChIKey is UFLWZCQXNMGTGF-LJQANCHMSA-N. The full InChI is InChI=1S/C21H19N3O2/c1-14-16(18-12-5-6-13-23-18)10-7-11-17(14)21(26)24-19(20(22)25)15-8-3-2-4-9-15/h2-13,19H,1H3,(H2,22,25)(H,24,26)/t19-/m1/s1.
What are the key properties of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide?
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide has a molecular weight of 345.40 g/mol, XLogP of 3.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide is sourced from PubChem (CID 97242872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).