N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide

C15H16N2O2 — CID 110730343

IUPACN-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide
SMILESCn1cccc(CNC(=O)Cc2ccccc2)c1=O
InChIInChI=1S/C15H16N2O2/c1-17-9-5-8-13(15(17)19)11-16-14(18)10-12-6-3-2-4-7-12/h2-9H,10-11H2,1H3,(H,16,18)
InChIKeyXTHNVEAXYSFEFO-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.24
Rot. Bonds4

About N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide

N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide (PubChem CID 110730343) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide
PubChem CID110730343
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide
SMILESCn1cccc(CNC(=O)Cc2ccccc2)c1=O
InChIInChI=1S/C15H16N2O2/c1-17-9-5-8-13(15(17)19)11-16-14(18)10-12-6-3-2-4-7-12/h2-9H,10-11H2,1H3,(H,16,18)
InChIKeyXTHNVEAXYSFEFO-UHFFFAOYSA-N
XLogP1.24
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide?
The IUPAC name of N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide (CID 110730343) is N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide.
What is the SMILES notation for N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide?
The canonical SMILES for N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide is Cn1cccc(CNC(=O)Cc2ccccc2)c1=O.
What is the InChIKey of N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide?
The InChIKey is XTHNVEAXYSFEFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-17-9-5-8-13(15(17)19)11-16-14(18)10-12-6-3-2-4-7-12/h2-9H,10-11H2,1H3,(H,16,18).
What are the key properties of N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide?
N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide has a molecular weight of 256.31 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-phenylacetamide is sourced from PubChem (CID 110730343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).