2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide

C16H14N4O3 — CID 71754172

IUPAC2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide
SMILESCc1nc2ccc(O)cc2c(=O)n1CC(=O)Nc1cccnc1
InChIInChI=1S/C16H14N4O3/c1-10-18-14-5-4-12(21)7-13(14)16(23)20(10)9-15(22)19-11-3-2-6-17-8-11/h2-8,21H,9H2,1H3,(H,19,22)
InChIKeyPANMSZWGDCNLRS-UHFFFAOYSA-N
MW310.31 g/mol
LogP1.44
Rot. Bonds3

About 2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide

2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide (PubChem CID 71754172) has the molecular formula C16H14N4O3 and a molecular weight of 310.31 g/mol. Its IUPAC name is 2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide
PubChem CID71754172
Molecular FormulaC16H14N4O3
Molecular Weight310.31 g/mol
Exact Mass310.11
IUPAC Name2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide
SMILESCc1nc2ccc(O)cc2c(=O)n1CC(=O)Nc1cccnc1
InChIInChI=1S/C16H14N4O3/c1-10-18-14-5-4-12(21)7-13(14)16(23)20(10)9-15(22)19-11-3-2-6-17-8-11/h2-8,21H,9H2,1H3,(H,19,22)
InChIKeyPANMSZWGDCNLRS-UHFFFAOYSA-N
XLogP1.44
TPSA97.11 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.31
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide (CID 71754172) is 2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide is Cc1nc2ccc(O)cc2c(=O)n1CC(=O)Nc1cccnc1.
What is the InChIKey of 2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide?
The InChIKey is PANMSZWGDCNLRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O3/c1-10-18-14-5-4-12(21)7-13(14)16(23)20(10)9-15(22)19-11-3-2-6-17-8-11/h2-8,21H,9H2,1H3,(H,19,22).
What are the key properties of 2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide?
2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide has a molecular weight of 310.31 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-N-pyridin-3-ylacetamide is sourced from PubChem (CID 71754172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).