N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide

C16H14N2O3 — CID 7384469

IUPACN-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide
SMILESO=C(Nc1cc2c3c(c1)CC(=O)N3CCC2)c1ccco1
InChIInChI=1S/C16H14N2O3/c19-14-9-11-8-12(17-16(20)13-4-2-6-21-13)7-10-3-1-5-18(14)15(10)11/h2,4,6-8H,1,3,5,9H2,(H,17,20)
InChIKeyQNGHWTSXOOJQBJ-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.37
Rot. Bonds2

About N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide

N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide (PubChem CID 7384469) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide
PubChem CID7384469
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC NameN-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide
SMILESO=C(Nc1cc2c3c(c1)CC(=O)N3CCC2)c1ccco1
InChIInChI=1S/C16H14N2O3/c19-14-9-11-8-12(17-16(20)13-4-2-6-21-13)7-10-3-1-5-18(14)15(10)11/h2,4,6-8H,1,3,5,9H2,(H,17,20)
InChIKeyQNGHWTSXOOJQBJ-UHFFFAOYSA-N
XLogP2.37
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(2s)-1-Acetyl-4-(Furan-2-Carbonyl)-2-Methyl-1,2,3,4-Tetrahydroquinoxalin-6-Yl]-N-Methylbenzamide
CID 118080305
N-[3-[[2-(diethylaminomethyl)phenyl]methylcarbamoyl]phenyl]furan-2-carboxamide
CID 152426927
1-(furan-2-carbonyl)-N-(4-methylphenyl)piperidine-4-carboxamide
CID 6463949
N-[3-(benzylcarbamoyl)phenyl]furan-2-carboxamide
CID 1331247
N-[2-(piperidine-1-carbonyl)phenyl]furan-2-carboxamide
CID 829463
N-{3-[(2-methylphenyl)carbamoyl]phenyl}furan-2-carboxamide
CID 1262944
N-(3-{[methyl(phenyl)amino]carbonyl}phenyl)-2-furamide
CID 2985334
N-[3-(2,3-dihydroindol-1-yl)-3-oxopropyl]furan-2-carboxamide
CID 4875841
N-[(1E)-3-(2,3-dihydro-1H-indol-1-yl)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
CID 6113396
N-(2,3-dimethylphenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide
CID 6463047
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 16333232
N-(1-methyl-2-oxo-2,4,5,6-tetrahydro-1H-pyrrolo[3,2,1-ij]quinolin-8-yl)-2-phenoxyacetamide
CID 16823178

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide?
The IUPAC name of N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide (CID 7384469) is N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide.
What is the SMILES notation for N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide?
The canonical SMILES for N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide is O=C(Nc1cc2c3c(c1)CC(=O)N3CCC2)c1ccco1.
What is the InChIKey of N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide?
The InChIKey is QNGHWTSXOOJQBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c19-14-9-11-8-12(17-16(20)13-4-2-6-21-13)7-10-3-1-5-18(14)15(10)11/h2,4,6-8H,1,3,5,9H2,(H,17,20).
What are the key properties of N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide?
N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)furan-2-carboxamide is sourced from PubChem (CID 7384469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).