2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide

C18H16Cl2N2O — CID 22627339

IUPAC2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide
SMILESCCc1c(Cl)n(Cc2ccccc2Cl)c2cc(C(N)=O)ccc12
InChIInChI=1S/C18H16Cl2N2O/c1-2-13-14-8-7-11(18(21)23)9-16(14)22(17(13)20)10-12-5-3-4-6-15(12)19/h3-9H,2,10H2,1H3,(H2,21,23)
InChIKeyZPVAJOFHDQMICQ-UHFFFAOYSA-N
MW347.25 g/mol
LogP4.66
Rot. Bonds4

About 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide

2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide (PubChem CID 22627339) has the molecular formula C18H16Cl2N2O and a molecular weight of 347.25 g/mol. Its IUPAC name is 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide.

Molecular Properties

Compound Name2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide
PubChem CID22627339
Molecular FormulaC18H16Cl2N2O
Molecular Weight347.25 g/mol
Exact Mass346.06
IUPAC Name2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide
SMILESCCc1c(Cl)n(Cc2ccccc2Cl)c2cc(C(N)=O)ccc12
InChIInChI=1S/C18H16Cl2N2O/c1-2-13-14-8-7-11(18(21)23)9-16(14)22(17(13)20)10-12-5-3-4-6-15(12)19/h3-9H,2,10H2,1H3,(H2,21,23)
InChIKeyZPVAJOFHDQMICQ-UHFFFAOYSA-N
XLogP4.66
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.25
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-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

1-[(2-chlorophenyl)methyl]-3-ethyl-2-propanoylindole-6-carboxamide
CID 10270421
1-[(2-chlorophenyl)methyl]-3-(morpholine-4-carbonyl)-2-propylindole-6-carboxamide
CID 22627368
2-butyl-3-[(2-chlorophenyl)methyl]benzimidazole-5-carboxamide;hydrochloride
CID 139615644
2-acetyl-1-[(2-chlorophenyl)methyl]-3-methylindole-6-carboxylic acid
CID 22627306
4-[(2-chlorophenyl)methyl]-3-ethylbenzamide
CID 174688363
1-[(2-chlorophenyl)methyl]-3-hexadecyl-2-propylindole-6-carboxylic acid
CID 150752665
methyl 1-[(2-chlorophenyl)methyl]-2-(2-methylpropanoyl)-3-propylindole-6-carboxylate
CID 22627428
1-[(2-chlorophenyl)methyl]-2-ethylindole-6-carboxylic acid
CID 150063466
methyl 1-[(2-chlorophenyl)methyl]-2-ethyl-3-(2-methylpropanoyl)indole-6-carboxylate
CID 22627324
1-[(2-chlorophenyl)methyl]-2-propylindole-4-carboxamide
CID 22627297
1-[(2-chlorophenyl)methyl]-3-(3-methylbutanoyl)-2-propylindole-6-carboxylic acid
CID 10223376
2-[(2-chlorophenyl)methyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide
CID 174310486

Frequently Asked Questions

What is the IUPAC name of 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide?
The IUPAC name of 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide (CID 22627339) is 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide.
What is the SMILES notation for 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide?
The canonical SMILES for 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide is CCc1c(Cl)n(Cc2ccccc2Cl)c2cc(C(N)=O)ccc12.
What is the InChIKey of 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide?
The InChIKey is ZPVAJOFHDQMICQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2N2O/c1-2-13-14-8-7-11(18(21)23)9-16(14)22(17(13)20)10-12-5-3-4-6-15(12)19/h3-9H,2,10H2,1H3,(H2,21,23).
What are the key properties of 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide?
2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide has a molecular weight of 347.25 g/mol, XLogP of 4.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1-[(2-chlorophenyl)methyl]-3-ethylindole-6-carboxamide is sourced from PubChem (CID 22627339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).