N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide

C20H25N3O2 — CID 20865251

IUPACN-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide
SMILESCCCCN(CC)C(=O)c1cc2c(=O)n(C)c3ccccc3c2n1C
InChIInChI=1S/C20H25N3O2/c1-5-7-12-23(6-2)20(25)17-13-15-18(21(17)3)14-10-8-9-11-16(14)22(4)19(15)24/h8-11,13H,5-7,12H2,1-4H3
InChIKeyXMLXCHCCPXNITG-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.29
Rot. Bonds5

About N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide

N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide (PubChem CID 20865251) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide
PubChem CID20865251
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide
SMILESCCCCN(CC)C(=O)c1cc2c(=O)n(C)c3ccccc3c2n1C
InChIInChI=1S/C20H25N3O2/c1-5-7-12-23(6-2)20(25)17-13-15-18(21(17)3)14-10-8-9-11-16(14)22(4)19(15)24/h8-11,13H,5-7,12H2,1-4H3
InChIKeyXMLXCHCCPXNITG-UHFFFAOYSA-N
XLogP3.29
TPSA47.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-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

Rhetsinine
CID 99652
Olinone
CID 91668531
6-fluoro-9-methyl-2-phenyl-4-(pyrrolidin-1-yl-carbonyl)-2,9-dihydro-1H-pyrido(3,4-b)indol-1-one
CID 9908378
(1H-indol-2-yl)(4-methylpiperazin-1-yl)methanone
CID 4060730
Rhazinal
CID 12041235
Tarazepide
CID 10343641
2,4-Dimethyl-pyrrolo[3,4-c]quinoline-1,3-dione
CID 706730
1-benzyl-2-ethyl-4,5,6,7-tetrahydro-1H-indol-4-one
CID 11128828
(1,6-Dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)(p-tolyl)methanone
CID 4871560
1-(2-methyl-1H-indol-3-yl)-2-(4-methylpiperazin-1-yl)ethane-1,2-dione
CID 7117510
(4-ethylpiperazin-1-yl)(1H-indol-2-yl)methanone
CID 11821243
1H-Pyrido(3,4-b)indol-1-one, 2,3,4,9-tetrahydro-9-methyl-2-(4-(4-phenyl-1-piperazinyl)butyl)-
CID 365677

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide?
The IUPAC name of N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide (CID 20865251) is N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide.
What is the SMILES notation for N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide?
The canonical SMILES for N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide is CCCCN(CC)C(=O)c1cc2c(=O)n(C)c3ccccc3c2n1C.
What is the InChIKey of N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide?
The InChIKey is XMLXCHCCPXNITG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-5-7-12-23(6-2)20(25)17-13-15-18(21(17)3)14-10-8-9-11-16(14)22(4)19(15)24/h8-11,13H,5-7,12H2,1-4H3.
What are the key properties of N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide?
N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 3.29, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-ethyl-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide is sourced from PubChem (CID 20865251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).