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

C15H15N3O3 — CID 3137931

IUPACN-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide
SMILESCCC(=O)Nc1ncc2c(n1)CC(c1ccco1)CC2=O
InChIInChI=1S/C15H15N3O3/c1-2-14(20)18-15-16-8-10-11(17-15)6-9(7-12(10)19)13-4-3-5-21-13/h3-5,8-9H,2,6-7H2,1H3,(H,16,17,18,20)
InChIKeyWTMDFBXINXUIAJ-UHFFFAOYSA-N
MW285.30 g/mol
LogP2.33
Rot. Bonds3

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

N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide (PubChem CID 3137931) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide.

Molecular Properties

Compound NameN-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide
PubChem CID3137931
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide
SMILESCCC(=O)Nc1ncc2c(n1)CC(c1ccco1)CC2=O
InChIInChI=1S/C15H15N3O3/c1-2-14(20)18-15-16-8-10-11(17-15)6-9(7-12(10)19)13-4-3-5-21-13/h3-5,8-9H,2,6-7H2,1H3,(H,16,17,18,20)
InChIKeyWTMDFBXINXUIAJ-UHFFFAOYSA-N
XLogP2.33
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]benzamide
CID 2886839
[2-[[(7S)-7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]amino]-2-oxoethyl] morpholine-4-carbodithioate
CID 2022143
N-[(7R)-7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]-3,4,5-trimethoxybenzamide
CID 2004861
1-(3,4-dichlorophenyl)-3-[(7R)-7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]urea
CID 1314954
2-[(4-fluorophenyl)methylamino]-7-(furan-2-yl)-7,8-dihydro-6H-quinazolin-5-one
CID 5297233
(7S)-2-[(4-fluorophenyl)methylamino]-7-(furan-2-yl)-7,8-dihydro-6H-quinazolin-5-one
CID 7332901
N-[7-[4-(dimethylamino)phenyl]-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide
CID 2985635
(7R)-7-(furan-2-yl)-2-[[(2R)-oxolan-2-yl]methylamino]-7,8-dihydro-6H-quinazolin-5-one
CID 2042847
(7R)-2-[(6-ethyl-4-methylquinazolin-2-yl)amino]-7-(furan-2-yl)-7,8-dihydro-6H-quinazolin-5-one
CID 1400850
2-[(4,7-dimethylquinazolin-2-yl)amino]-7-(furan-2-yl)-7,8-dihydro-6H-quinazolin-5-one
CID 3725042
N-[(7S)-5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl]furan-2-carboxamide
CID 940577
(7R)-2-[(6-ethoxy-4-methylquinazolin-2-yl)amino]-7-(furan-2-yl)-7,8-dihydro-6H-quinazolin-5-one
CID 1399294

Frequently Asked Questions

What is the IUPAC name of N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide?
The IUPAC name of N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide (CID 3137931) is N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide.
What is the SMILES notation for N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide?
The canonical SMILES for N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide is CCC(=O)Nc1ncc2c(n1)CC(c1ccco1)CC2=O.
What is the InChIKey of N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide?
The InChIKey is WTMDFBXINXUIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-2-14(20)18-15-16-8-10-11(17-15)6-9(7-12(10)19)13-4-3-5-21-13/h3-5,8-9H,2,6-7H2,1H3,(H,16,17,18,20).
What are the key properties of N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide?
N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide has a molecular weight of 285.30 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(furan-2-yl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]propanamide is sourced from PubChem (CID 3137931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).