1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide

C18H16N4O2 — CID 163314941

IUPAC1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide
SMILESCc1cc(-c2ccccc2)nc(NC(=O)c2ccn(C)c(=O)c2)n1
InChIInChI=1S/C18H16N4O2/c1-12-10-15(13-6-4-3-5-7-13)20-18(19-12)21-17(24)14-8-9-22(2)16(23)11-14/h3-11H,1-2H3,(H,19,20,21,24)
InChIKeyQKPRGOPNRWWZDU-UHFFFAOYSA-N
MW320.35 g/mol
LogP2.40
Rot. Bonds3

About 1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide

1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide (PubChem CID 163314941) has the molecular formula C18H16N4O2 and a molecular weight of 320.35 g/mol. Its IUPAC name is 1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide
PubChem CID163314941
Molecular FormulaC18H16N4O2
Molecular Weight320.35 g/mol
Exact Mass320.13
IUPAC Name1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide
SMILESCc1cc(-c2ccccc2)nc(NC(=O)c2ccn(C)c(=O)c2)n1
InChIInChI=1S/C18H16N4O2/c1-12-10-15(13-6-4-3-5-7-13)20-18(19-12)21-17(24)14-8-9-22(2)16(23)11-14/h3-11H,1-2H3,(H,19,20,21,24)
InChIKeyQKPRGOPNRWWZDU-UHFFFAOYSA-N
XLogP2.40
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide?
The IUPAC name of 1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide (CID 163314941) is 1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide.
What is the SMILES notation for 1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide?
The canonical SMILES for 1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide is Cc1cc(-c2ccccc2)nc(NC(=O)c2ccn(C)c(=O)c2)n1.
What is the InChIKey of 1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide?
The InChIKey is QKPRGOPNRWWZDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2/c1-12-10-15(13-6-4-3-5-7-13)20-18(19-12)21-17(24)14-8-9-22(2)16(23)11-14/h3-11H,1-2H3,(H,19,20,21,24).
What are the key properties of 1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide?
1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide has a molecular weight of 320.35 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(4-methyl-6-phenylpyrimidin-2-yl)-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 163314941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).