7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide

C17H14Cl2N2O3 — CID 108791790

IUPAC7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide
SMILESCOc1cc(NC(=O)c2cc3cccc(Cl)c3[nH]2)c(OC)cc1Cl
InChIInChI=1S/C17H14Cl2N2O3/c1-23-14-8-12(15(24-2)7-11(14)19)21-17(22)13-6-9-4-3-5-10(18)16(9)20-13/h3-8,20H,1-2H3,(H,21,22)
InChIKeyNOOCTAIXDGGRKS-UHFFFAOYSA-N
MW365.22 g/mol
LogP4.74
Rot. Bonds4

About 7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide

7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide (PubChem CID 108791790) has the molecular formula C17H14Cl2N2O3 and a molecular weight of 365.22 g/mol. Its IUPAC name is 7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide
PubChem CID108791790
Molecular FormulaC17H14Cl2N2O3
Molecular Weight365.22 g/mol
Exact Mass364.04
IUPAC Name7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide
SMILESCOc1cc(NC(=O)c2cc3cccc(Cl)c3[nH]2)c(OC)cc1Cl
InChIInChI=1S/C17H14Cl2N2O3/c1-23-14-8-12(15(24-2)7-11(14)19)21-17(22)13-6-9-4-3-5-10(18)16(9)20-13/h3-8,20H,1-2H3,(H,21,22)
InChIKeyNOOCTAIXDGGRKS-UHFFFAOYSA-N
XLogP4.74
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.22
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

7-chloro-N-(3-chloro-4-methoxyphenyl)-1H-indole-2-carboxamide
CID 108791613
7-methoxy-N-phenyl-1H-indole-2-carboxamide
CID 110856487
N-(4-chloro-2,5-dimethoxyphenyl)-3-fluorobenzamide
CID 4060765
7-chloro-N-(2,6-diethylphenyl)-1H-indole-2-carboxamide
CID 108791658
7-chloro-1H-indole-2-carbohydrazide
CID 13466352
N-(5-chloro-2,4-dimethoxyphenyl)naphthalene-1-carboxamide
CID 823910
N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide
CID 108791596
methyl 3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]benzoate
CID 46485057
7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide
CID 108791741
7-chloro-N-(4-cyanophenyl)-1H-indole-2-carboxamide
CID 108791683
N-(4-chloro-2,5-dimethoxyphenyl)-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
CID 26069017
N-(5-chloro-2,4-dimethoxyphenyl)benzamide
CID 835257

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide?
The IUPAC name of 7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide (CID 108791790) is 7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide?
The canonical SMILES for 7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide is COc1cc(NC(=O)c2cc3cccc(Cl)c3[nH]2)c(OC)cc1Cl.
What is the InChIKey of 7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide?
The InChIKey is NOOCTAIXDGGRKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl2N2O3/c1-23-14-8-12(15(24-2)7-11(14)19)21-17(22)13-6-9-4-3-5-10(18)16(9)20-13/h3-8,20H,1-2H3,(H,21,22).
What are the key properties of 7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide?
7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide has a molecular weight of 365.22 g/mol, XLogP of 4.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 108791790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).