3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide

C19H18ClN3O3 — CID 46391875

IUPAC3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide
SMILESCOCCNC(=O)c1[nH]c2ccccc2c1NC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C19H18ClN3O3/c1-26-11-10-21-19(25)17-16(14-4-2-3-5-15(14)22-17)23-18(24)12-6-8-13(20)9-7-12/h2-9,22H,10-11H2,1H3,(H,21,25)(H,23,24)
InChIKeyRZUIFLSDQUMJSH-UHFFFAOYSA-N
MW371.82 g/mol
LogP3.45
Rot. Bonds6

About 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide

3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide (PubChem CID 46391875) has the molecular formula C19H18ClN3O3 and a molecular weight of 371.82 g/mol. Its IUPAC name is 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide
PubChem CID46391875
Molecular FormulaC19H18ClN3O3
Molecular Weight371.82 g/mol
Exact Mass371.10
IUPAC Name3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide
SMILESCOCCNC(=O)c1[nH]c2ccccc2c1NC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C19H18ClN3O3/c1-26-11-10-21-19(25)17-16(14-4-2-3-5-15(14)22-17)23-18(24)12-6-8-13(20)9-7-12/h2-9,22H,10-11H2,1H3,(H,21,25)(H,23,24)
InChIKeyRZUIFLSDQUMJSH-UHFFFAOYSA-N
XLogP3.45
TPSA83.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.82
LogP ≤ 53.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-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-[(4-chlorobenzoyl)amino]-5-methyl-N-propyl-1H-indole-2-carboxamide
CID 50834469
4-chloro-N-(2-methoxyethyl)benzamide
CID 3457742
N-(3-methoxypropyl)-5-methyl-3-[(4-methylbenzoyl)amino]-1H-indole-2-carboxamide
CID 46391803
N-[(3,5-difluorophenyl)methyl]-3-[(4-methylbenzoyl)amino]-1H-indole-2-carboxamide
CID 46391848
3-[(4-chlorobenzoyl)amino]-5-methyl-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide
CID 46391849
5-chloro-N-(2-methoxyethyl)-3-thiophen-2-yl-1H-indole-2-carboxamide
CID 174358730
4-chloro-N-[2-(4-pyridin-2-ylpiperazine-1-carbonyl)-1H-indol-3-yl]benzamide
CID 46391888
N-(2-benzoyl-6-chloro-1H-indol-3-yl)-4-methoxybenzamide
CID 18367863
4-N-(2,6-diethylphenyl)-1-N-(2-methoxyethyl)benzene-1,4-dicarboxamide
CID 109045164
1-[(4-chlorobenzoyl)amino]-3-(2-methoxyethyl)urea
CID 47133922
3-(4-chlorophenyl)sulfanyl-N-propyl-1H-indole-2-carboxamide
CID 6623806
ethyl 3-[(4-nitrobenzoyl)amino]-1H-indole-2-carboxylate
CID 4179988

Frequently Asked Questions

What is the IUPAC name of 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide?
The IUPAC name of 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide (CID 46391875) is 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide?
The canonical SMILES for 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide is COCCNC(=O)c1[nH]c2ccccc2c1NC(=O)c1ccc(Cl)cc1.
What is the InChIKey of 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide?
The InChIKey is RZUIFLSDQUMJSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O3/c1-26-11-10-21-19(25)17-16(14-4-2-3-5-15(14)22-17)23-18(24)12-6-8-13(20)9-7-12/h2-9,22H,10-11H2,1H3,(H,21,25)(H,23,24).
What are the key properties of 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide?
3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide has a molecular weight of 371.82 g/mol, XLogP of 3.45, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-chlorobenzoyl)amino]-N-(2-methoxyethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 46391875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).