2-oxo-N-phenyl-1H-quinazoline-4-carboxamide

C15H11N3O2 — CID 24749598

IUPAC2-oxo-N-phenyl-1H-quinazoline-4-carboxamide
SMILESO=C(Nc1ccccc1)c1nc(=O)[nH]c2ccccc12
InChIInChI=1S/C15H11N3O2/c19-14(16-10-6-2-1-3-7-10)13-11-8-4-5-9-12(11)17-15(20)18-13/h1-9H,(H,16,19)(H,17,18,20)
InChIKeyIBKXBRUBWALIOJ-UHFFFAOYSA-N
MW265.27 g/mol
LogP2.18
Rot. Bonds2

About 2-oxo-N-phenyl-1H-quinazoline-4-carboxamide

2-oxo-N-phenyl-1H-quinazoline-4-carboxamide (PubChem CID 24749598) has the molecular formula C15H11N3O2 and a molecular weight of 265.27 g/mol. Its IUPAC name is 2-oxo-N-phenyl-1H-quinazoline-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N-phenyl-1H-quinazoline-4-carboxamide
PubChem CID24749598
Molecular FormulaC15H11N3O2
Molecular Weight265.27 g/mol
Exact Mass265.09
IUPAC Name2-oxo-N-phenyl-1H-quinazoline-4-carboxamide
SMILESO=C(Nc1ccccc1)c1nc(=O)[nH]c2ccccc12
InChIInChI=1S/C15H11N3O2/c19-14(16-10-6-2-1-3-7-10)13-11-8-4-5-9-12(11)17-15(20)18-13/h1-9H,(H,16,19)(H,17,18,20)
InChIKeyIBKXBRUBWALIOJ-UHFFFAOYSA-N
XLogP2.18
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2(1H)-Quinazolinone, 4-phenyl-
CID 63430
3-Phenylquinoxalin-2(1H)-one
CID 346902
4-p-Tolyl-quinazolin-2-ol
CID 712790
3-(2-aminophenyl)quinoxalin-2(1H)-one
CID 262953
2-Benzyl-3-hydroxyquinoxaline
CID 659725
3-(4-Methylanilino)indol-2-one
CID 135412515
N-(2-Methylphenyl)benzeneacetamide
CID 38661
2-Indolinone, 3-(phenylimino)-
CID 135442567
1,3-Dihydro-4-phenyl-2H-1,5-benzodiazepin-2-one
CID 177746
3-Hydroxy-2-phenylquinoxalin-1-ium-1-olate
CID 736441
3-(4-Methylphenyl)-2-quinoxalinol
CID 807691
3-(2-Phenylethyl)-1H-quinoxalin-2-one
CID 4884003

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-phenyl-1H-quinazoline-4-carboxamide?
The IUPAC name of 2-oxo-N-phenyl-1H-quinazoline-4-carboxamide (CID 24749598) is 2-oxo-N-phenyl-1H-quinazoline-4-carboxamide.
What is the SMILES notation for 2-oxo-N-phenyl-1H-quinazoline-4-carboxamide?
The canonical SMILES for 2-oxo-N-phenyl-1H-quinazoline-4-carboxamide is O=C(Nc1ccccc1)c1nc(=O)[nH]c2ccccc12.
What is the InChIKey of 2-oxo-N-phenyl-1H-quinazoline-4-carboxamide?
The InChIKey is IBKXBRUBWALIOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O2/c19-14(16-10-6-2-1-3-7-10)13-11-8-4-5-9-12(11)17-15(20)18-13/h1-9H,(H,16,19)(H,17,18,20).
What are the key properties of 2-oxo-N-phenyl-1H-quinazoline-4-carboxamide?
2-oxo-N-phenyl-1H-quinazoline-4-carboxamide has a molecular weight of 265.27 g/mol, XLogP of 2.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-phenyl-1H-quinazoline-4-carboxamide is sourced from PubChem (CID 24749598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).