1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide

C11H10N4O2 — CID 104856811

IUPAC1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide
SMILESCn1ccc(C(=O)Nc2cncnc2)cc1=O
InChIInChI=1S/C11H10N4O2/c1-15-3-2-8(4-10(15)16)11(17)14-9-5-12-7-13-6-9/h2-7H,1H3,(H,14,17)
InChIKeyKQZUMXPWQJVVRU-UHFFFAOYSA-N
MW230.23 g/mol
LogP0.43
Rot. Bonds2

About 1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide

1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide (PubChem CID 104856811) has the molecular formula C11H10N4O2 and a molecular weight of 230.23 g/mol. Its IUPAC name is 1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide
PubChem CID104856811
Molecular FormulaC11H10N4O2
Molecular Weight230.23 g/mol
Exact Mass230.08
IUPAC Name1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide
SMILESCn1ccc(C(=O)Nc2cncnc2)cc1=O
InChIInChI=1S/C11H10N4O2/c1-15-3-2-8(4-10(15)16)11(17)14-9-5-12-7-13-6-9/h2-7H,1H3,(H,14,17)
InChIKeyKQZUMXPWQJVVRU-UHFFFAOYSA-N
XLogP0.43
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.23
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide?
The IUPAC name of 1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide (CID 104856811) is 1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide.
What is the SMILES notation for 1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide?
The canonical SMILES for 1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide is Cn1ccc(C(=O)Nc2cncnc2)cc1=O.
What is the InChIKey of 1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide?
The InChIKey is KQZUMXPWQJVVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O2/c1-15-3-2-8(4-10(15)16)11(17)14-9-5-12-7-13-6-9/h2-7H,1H3,(H,14,17).
What are the key properties of 1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide?
1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide has a molecular weight of 230.23 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-oxo-N-pyrimidin-5-ylpyridine-4-carboxamide is sourced from PubChem (CID 104856811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).