N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide

C24H26N4O3 — CID 86874777

IUPACN-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
SMILESCCN(CC)C(=O)Cn1ccc2cc(NC(=O)C3CC(=O)Nc4ccccc43)ccc21
InChIInChI=1S/C24H26N4O3/c1-3-27(4-2)23(30)15-28-12-11-16-13-17(9-10-21(16)28)25-24(31)19-14-22(29)26-20-8-6-5-7-18(19)20/h5-13,19H,3-4,14-15H2,1-2H3,(H,25,31)(H,26,29)
InChIKeyYMZMXFDFUAURBZ-UHFFFAOYSA-N
MW418.50 g/mol
LogP3.57
Rot. Bonds6

About N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide

N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide (PubChem CID 86874777) has the molecular formula C24H26N4O3 and a molecular weight of 418.50 g/mol. Its IUPAC name is N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
PubChem CID86874777
Molecular FormulaC24H26N4O3
Molecular Weight418.50 g/mol
Exact Mass418.20
IUPAC NameN-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
SMILESCCN(CC)C(=O)Cn1ccc2cc(NC(=O)C3CC(=O)Nc4ccccc43)ccc21
InChIInChI=1S/C24H26N4O3/c1-3-27(4-2)23(30)15-28-12-11-16-13-17(9-10-21(16)28)25-24(31)19-14-22(29)26-20-8-6-5-7-18(19)20/h5-13,19H,3-4,14-15H2,1-2H3,(H,25,31)(H,26,29)
InChIKeyYMZMXFDFUAURBZ-UHFFFAOYSA-N
XLogP3.57
TPSA83.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.50
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide with MolForge

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Related Compounds

N-[3-chloro-4-(diethylcarbamoyl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 55673090
N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]cyclohexanecarboxamide
CID 47089802
(4S)-N-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 51531802
1-amino-N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]cyclopropane-1-carboxamide
CID 119764130
2-oxo-N-phenyl-3,4-dihydro-1H-quinoline-4-carboxamide
CID 17493174
1-amino-N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]cyclohexane-1-carboxamide
CID 119312265
N-(1,3-benzodioxol-5-yl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 17488439
N,N-diethyl-2-[4-(2-oxo-3,4-dihydro-1H-quinoline-4-carbonyl)piperazin-1-yl]acetamide
CID 55507256
N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-pyrazol-1-ylbenzamide
CID 86874806
(4S)-N-(4-chlorophenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 51478917
(4S)-N-[4-(methylcarbamoyl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 26078441
4,5-dichloro-N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-1H-pyrrole-2-carboxamide
CID 86874780

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
The IUPAC name of N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide (CID 86874777) is N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
The canonical SMILES for N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide is CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C3CC(=O)Nc4ccccc43)ccc21.
What is the InChIKey of N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
The InChIKey is YMZMXFDFUAURBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O3/c1-3-27(4-2)23(30)15-28-12-11-16-13-17(9-10-21(16)28)25-24(31)19-14-22(29)26-20-8-6-5-7-18(19)20/h5-13,19H,3-4,14-15H2,1-2H3,(H,25,31)(H,26,29).
What are the key properties of N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide?
N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide has a molecular weight of 418.50 g/mol, XLogP of 3.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(diethylamino)-2-oxoethyl]indol-5-yl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide is sourced from PubChem (CID 86874777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).