(2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide

C17H19N3O3 — CID 97007888

IUPAC(2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide
SMILESCNC(=O)[C@@H](NC(=O)Cn1ccc(C)cc1=O)c1ccccc1
InChIInChI=1S/C17H19N3O3/c1-12-8-9-20(15(22)10-12)11-14(21)19-16(17(23)18-2)13-6-4-3-5-7-13/h3-10,16H,11H2,1-2H3,(H,18,23)(H,19,21)/t16-/m0/s1
InChIKeyQZAFVKXGZVBRJD-INIZCTEOSA-N
MW313.36 g/mol
LogP0.76
Rot. Bonds5

About (2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide

(2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide (PubChem CID 97007888) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is (2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide
PubChem CID97007888
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name(2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide
SMILESCNC(=O)[C@@H](NC(=O)Cn1ccc(C)cc1=O)c1ccccc1
InChIInChI=1S/C17H19N3O3/c1-12-8-9-20(15(22)10-12)11-14(21)19-16(17(23)18-2)13-6-4-3-5-7-13/h3-10,16H,11H2,1-2H3,(H,18,23)(H,19,21)/t16-/m0/s1
InChIKeyQZAFVKXGZVBRJD-INIZCTEOSA-N
XLogP0.76
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-methyl-2-[[2-(4-methylphenyl)acetyl]amino]-2-phenylacetamide
CID 71906698
2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid
CID 146134067
N-(3-bromophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 115614106
1-(2-hydroxy-2-phenylethyl)-4-methylpyridin-2-one
CID 55153499
N-(2-aminophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 62962477
(2R)-N-methyl-2-[[2-(2-methylprop-2-enylsulfanyl)acetyl]amino]-2-phenylacetamide
CID 97089947
methyl 2-(4-methyl-2-oxo-1-pyridinyl)acetate
CID 59562280
N-(3-carbamothioylphenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 62962868
2-[[2-[(3-bromophenyl)methylsulfanyl]acetyl]amino]-N-methyl-2-phenylacetamide
CID 112842183
3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]propanoic acid
CID 163260414
methyl 2-(4-methyl-2-oxo-1-pyridinyl)acetate;2-(4-methyl-2-oxo-1-pyridinyl)acetic acid
CID 160822702
N-methyl-2-(methylamino)-2-phenylacetamide
CID 3738076

Frequently Asked Questions

What is the IUPAC name of (2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide?
The IUPAC name of (2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide (CID 97007888) is (2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide.
What is the SMILES notation for (2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide?
The canonical SMILES for (2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide is CNC(=O)[C@@H](NC(=O)Cn1ccc(C)cc1=O)c1ccccc1.
What is the InChIKey of (2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide?
The InChIKey is QZAFVKXGZVBRJD-INIZCTEOSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-12-8-9-20(15(22)10-12)11-14(21)19-16(17(23)18-2)13-6-4-3-5-7-13/h3-10,16H,11H2,1-2H3,(H,18,23)(H,19,21)/t16-/m0/s1.
What are the key properties of (2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide?
(2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide has a molecular weight of 313.36 g/mol, XLogP of 0.76, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide is sourced from PubChem (CID 97007888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).