N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide

C13H11N3O3 — CID 943501

IUPACN-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide
SMILESO=C(Nc1ncc2c(n1)CCCC2=O)c1ccco1
InChIInChI=1S/C13H11N3O3/c17-10-4-1-3-9-8(10)7-14-13(15-9)16-12(18)11-5-2-6-19-11/h2,5-7H,1,3-4H2,(H,14,15,16,18)
InChIKeyPPJLGTXPPYMJKH-UHFFFAOYSA-N
MW257.25 g/mol
LogP1.84
Rot. Bonds2

About N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide

N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide (PubChem CID 943501) has the molecular formula C13H11N3O3 and a molecular weight of 257.25 g/mol. Its IUPAC name is N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide
PubChem CID943501
Molecular FormulaC13H11N3O3
Molecular Weight257.25 g/mol
Exact Mass257.08
IUPAC NameN-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide
SMILESO=C(Nc1ncc2c(n1)CCCC2=O)c1ccco1
InChIInChI=1S/C13H11N3O3/c17-10-4-1-3-9-8(10)7-14-13(15-9)16-12(18)11-5-2-6-19-11/h2,5-7H,1,3-4H2,(H,14,15,16,18)
InChIKeyPPJLGTXPPYMJKH-UHFFFAOYSA-N
XLogP1.84
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.25
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(7S)-5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl]furan-2-carboxamide
CID 940577
N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]benzamide
CID 2886839
N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide
CID 3137931
2-amino-7,8-dihydro-6H-quinazolin-5-one;hydrochloride
CID 56777519
N-(2-pyrrolidin-1-ylpyrimidin-5-yl)furan-2-carboxamide
CID 71789966
2-(3,5-dimethylanilino)-7,8-dihydro-6H-quinazolin-5-one
CID 665694
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
2-[(4-methylquinazolin-2-yl)amino]-7,8-dihydro-6H-quinazolin-5-one
CID 662203
N-[4-[(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]pyrimidin-2-yl]furan-2-carboxamide
CID 123929624
N-cyclooctylfuran-2-carboxamide
CID 790432
N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]furan-2-carboxamide
CID 110461158
N-(2,6-diamino-3-pyridinyl)furan-2-carboxamide
CID 110178922

Frequently Asked Questions

What is the IUPAC name of N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide?
The IUPAC name of N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide (CID 943501) is N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide.
What is the SMILES notation for N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide?
The canonical SMILES for N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide is O=C(Nc1ncc2c(n1)CCCC2=O)c1ccco1.
What is the InChIKey of N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide?
The InChIKey is PPJLGTXPPYMJKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O3/c17-10-4-1-3-9-8(10)7-14-13(15-9)16-12(18)11-5-2-6-19-11/h2,5-7H,1,3-4H2,(H,14,15,16,18).
What are the key properties of N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide?
N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide has a molecular weight of 257.25 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-oxo-7,8-dihydro-6H-quinazolin-2-yl)furan-2-carboxamide is sourced from PubChem (CID 943501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).