2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide

C20H18N2O2 — CID 3049733

IUPAC2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)Nc2ccccc2)c(C)n1-c1ccccc1
InChIInChI=1S/C20H18N2O2/c1-14-13-18(23)19(20(24)21-16-9-5-3-6-10-16)15(2)22(14)17-11-7-4-8-12-17/h3-13H,1-2H3,(H,21,24)
InChIKeyXNMPOLGMSVHZFT-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.71
Rot. Bonds3

About 2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide

2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide (PubChem CID 3049733) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide
PubChem CID3049733
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC Name2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)Nc2ccccc2)c(C)n1-c1ccccc1
InChIInChI=1S/C20H18N2O2/c1-14-13-18(23)19(20(24)21-16-9-5-3-6-10-16)15(2)22(14)17-11-7-4-8-12-17/h3-13H,1-2H3,(H,21,24)
InChIKeyXNMPOLGMSVHZFT-UHFFFAOYSA-N
XLogP3.71
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide?
The IUPAC name of 2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide (CID 3049733) is 2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide.
What is the SMILES notation for 2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide?
The canonical SMILES for 2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide is Cc1cc(=O)c(C(=O)Nc2ccccc2)c(C)n1-c1ccccc1.
What is the InChIKey of 2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide?
The InChIKey is XNMPOLGMSVHZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-14-13-18(23)19(20(24)21-16-9-5-3-6-10-16)15(2)22(14)17-11-7-4-8-12-17/h3-13H,1-2H3,(H,21,24).
What are the key properties of 2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide?
2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-oxo-N,1-diphenylpyridine-3-carboxamide is sourced from PubChem (CID 3049733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).