5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide

C24H27ClN4O3 — CID 83282703

IUPAC5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide
SMILESCCn1c(C(=O)NCCN2CCOCC2)cc2cc(NC(=O)c3ccccc3Cl)ccc21
InChIInChI=1S/C24H27ClN4O3/c1-2-29-21-8-7-18(27-23(30)19-5-3-4-6-20(19)25)15-17(21)16-22(29)24(31)26-9-10-28-11-13-32-14-12-28/h3-8,15-16H,2,9-14H2,1H3,(H,26,31)(H,27,30)
InChIKeyBTBGDKTXMVQTLV-UHFFFAOYSA-N
MW454.96 g/mol
LogP3.63
Rot. Bonds7

About 5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide

5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide (PubChem CID 83282703) has the molecular formula C24H27ClN4O3 and a molecular weight of 454.96 g/mol. Its IUPAC name is 5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide.

Molecular Properties

Compound Name5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide
PubChem CID83282703
Molecular FormulaC24H27ClN4O3
Molecular Weight454.96 g/mol
Exact Mass454.18
IUPAC Name5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide
SMILESCCn1c(C(=O)NCCN2CCOCC2)cc2cc(NC(=O)c3ccccc3Cl)ccc21
InChIInChI=1S/C24H27ClN4O3/c1-2-29-21-8-7-18(27-23(30)19-5-3-4-6-20(19)25)15-17(21)16-22(29)24(31)26-9-10-28-11-13-32-14-12-28/h3-8,15-16H,2,9-14H2,1H3,(H,26,31)(H,27,30)
InChIKeyBTBGDKTXMVQTLV-UHFFFAOYSA-N
XLogP3.63
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.96
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-5-[(4-methylbenzoyl)amino]-N-(2-morpholin-4-ylethyl)indole-2-carboxamide
CID 83288364
5-[(2-chlorobenzoyl)amino]-1-ethylindole-2-carboxamide
CID 83282724
2-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 799090
5-[(2-chlorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)-2-pyrrolidin-1-ylbenzamide
CID 1063900
5-[(4-tert-butylphenyl)sulfonylamino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide
CID 83282650
5-[(2-chlorobenzoyl)amino]-1-[(4-fluorophenyl)methyl]-N-(2-methoxyethyl)indole-2-carboxamide
CID 83284031
2-(4-benzylpiperidin-1-yl)-5-[(2-chlorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
CID 1063922
1-ethyl-5-[(2-fluorobenzoyl)amino]indole-2-carboxamide
CID 83282725
1-(3-chloro-4-methylphenyl)-3-(2-morpholin-4-ylethyl)urea
CID 3579443
N-[1-methyl-5-[[1-methyl-5-[[1-methyl-5-(2-morpholin-4-ylethylcarbamoyl)pyrrol-3-yl]carbamoyl]pyrrol-3-yl]carbamoyl]pyrrol-3-yl]pyridine-2-carboxamide
CID 10984873
5-[(2-chlorobenzoyl)amino]-1-[(3-methylphenyl)methyl]-N-(2-pyridin-2-ylethyl)indole-2-carboxamide
CID 42808893
2-(dimethylamino)-5-[(2-methoxybenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
CID 3531074

Frequently Asked Questions

What is the IUPAC name of 5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide?
The IUPAC name of 5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide (CID 83282703) is 5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide.
What is the SMILES notation for 5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide?
The canonical SMILES for 5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide is CCn1c(C(=O)NCCN2CCOCC2)cc2cc(NC(=O)c3ccccc3Cl)ccc21.
What is the InChIKey of 5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide?
The InChIKey is BTBGDKTXMVQTLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27ClN4O3/c1-2-29-21-8-7-18(27-23(30)19-5-3-4-6-20(19)25)15-17(21)16-22(29)24(31)26-9-10-28-11-13-32-14-12-28/h3-8,15-16H,2,9-14H2,1H3,(H,26,31)(H,27,30).
What are the key properties of 5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide?
5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide has a molecular weight of 454.96 g/mol, XLogP of 3.63, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide is sourced from PubChem (CID 83282703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).