5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide

C24H19N3O3 — CID 23770832

IUPAC5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide
SMILESO=C(NCc1ccco1)c1ccc2c(c1)n(Cc1ccccc1)c(=O)c1cccn12
InChIInChI=1S/C24H19N3O3/c28-23(25-15-19-8-5-13-30-19)18-10-11-20-22(14-18)27(16-17-6-2-1-3-7-17)24(29)21-9-4-12-26(20)21/h1-14H,15-16H2,(H,25,28)
InChIKeyVIDQTTDAOKROOS-UHFFFAOYSA-N
MW397.43 g/mol
LogP3.83
Rot. Bonds5

About 5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide

5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide (PubChem CID 23770832) has the molecular formula C24H19N3O3 and a molecular weight of 397.43 g/mol. Its IUPAC name is 5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide.

Molecular Properties

Compound Name5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide
PubChem CID23770832
Molecular FormulaC24H19N3O3
Molecular Weight397.43 g/mol
Exact Mass397.14
IUPAC Name5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide
SMILESO=C(NCc1ccco1)c1ccc2c(c1)n(Cc1ccccc1)c(=O)c1cccn12
InChIInChI=1S/C24H19N3O3/c28-23(25-15-19-8-5-13-30-19)18-10-11-20-22(14-18)27(16-17-6-2-1-3-7-17)24(29)21-9-4-12-26(20)21/h1-14H,15-16H2,(H,25,28)
InChIKeyVIDQTTDAOKROOS-UHFFFAOYSA-N
XLogP3.83
TPSA68.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.43
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-5-[(3-methylphenyl)methyl]-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide
CID 23881223
5-[(3-methylphenyl)methyl]-4-oxo-N-(thiophen-2-ylmethyl)pyrrolo[1,2-a]quinoxaline-7-carboxamide
CID 23910482
3-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5-yl)-N-(furan-2-ylmethyl)propanamide
CID 46272762
3-[[[4-[(1,3-dioxoisoindol-2-yl)methyl]benzoyl]amino]methyl]-N-(furan-2-ylmethyl)benzamide
CID 55877403
4-benzyl-N-(furan-2-ylmethyl)-3-oxo-5H-1,4-benzoxazepine-7-carboxamide
CID 91894716
5-[(3,5-dimethylphenyl)methyl]-4-oxo-N-(oxolan-2-ylmethyl)pyrrolo[1,2-a]quinoxaline-7-carboxamide
CID 23987968
1-N,3-N-bis(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 743261
3-benzyl-2-[2-(3-chlorophenyl)-2-oxoethyl]sulfanyl-N-(furan-2-ylmethyl)-4-oxoquinazoline-7-carboxamide
CID 46284400
N-(furan-2-ylmethyl)-3-[[2-oxo-3-(trifluoromethyl)-1-pyridinyl]methyl]benzamide
CID 47061689
N-(furan-2-ylmethyl)-4-[[1-[(2-methylphenyl)methyl]-2,4-dioxoquinazolin-3-yl]methyl]benzamide
CID 15995765
N-(furan-2-ylmethyl)-3-[(4-methoxyphenyl)methyl]-2,4-dioxo-1H-quinazoline-7-carboxamide
CID 15995150
4-[[1-[(2-fluorophenyl)methyl]-2,4-dioxoquinazolin-3-yl]methyl]-N-(furan-2-ylmethyl)benzamide
CID 22429669

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide?
The IUPAC name of 5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide (CID 23770832) is 5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide.
What is the SMILES notation for 5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide?
The canonical SMILES for 5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide is O=C(NCc1ccco1)c1ccc2c(c1)n(Cc1ccccc1)c(=O)c1cccn12.
What is the InChIKey of 5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide?
The InChIKey is VIDQTTDAOKROOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O3/c28-23(25-15-19-8-5-13-30-19)18-10-11-20-22(14-18)27(16-17-6-2-1-3-7-17)24(29)21-9-4-12-26(20)21/h1-14H,15-16H2,(H,25,28).
What are the key properties of 5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide?
5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide has a molecular weight of 397.43 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-N-(furan-2-ylmethyl)-4-oxopyrrolo[1,2-a]quinoxaline-7-carboxamide is sourced from PubChem (CID 23770832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).