5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide

C16H12Cl2N2O2 — CID 113207229

IUPAC5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1cc2cc(Cl)ccc2[nH]1
InChIInChI=1S/C16H12Cl2N2O2/c1-22-15-5-3-11(18)8-13(15)20-16(21)14-7-9-6-10(17)2-4-12(9)19-14/h2-8,19H,1H3,(H,20,21)
InChIKeyWYIPUMFBXLYUQS-UHFFFAOYSA-N
MW335.19 g/mol
LogP4.74
Rot. Bonds3

About 5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide

5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide (PubChem CID 113207229) has the molecular formula C16H12Cl2N2O2 and a molecular weight of 335.19 g/mol. Its IUPAC name is 5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide
PubChem CID113207229
Molecular FormulaC16H12Cl2N2O2
Molecular Weight335.19 g/mol
Exact Mass334.03
IUPAC Name5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1cc2cc(Cl)ccc2[nH]1
InChIInChI=1S/C16H12Cl2N2O2/c1-22-15-5-3-11(18)8-13(15)20-16(21)14-7-9-6-10(17)2-4-12(9)19-14/h2-8,19H,1H3,(H,20,21)
InChIKeyWYIPUMFBXLYUQS-UHFFFAOYSA-N
XLogP4.74
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.19
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide
CID 9068762
N-(3-acetamido-4-methoxyphenyl)-5-chloro-1H-indole-2-carboxamide
CID 55556002
5-chloro-N-(4-chloro-2-methoxy-5-methylphenyl)-1H-indole-2-carboxamide
CID 113207257
5-chloro-N-[4-methoxy-3-[(2-methylbenzoyl)amino]phenyl]-1H-indole-2-carboxamide
CID 46323222
methyl 4-chloro-3-[(5-chloro-1H-indole-2-carbonyl)amino]benzoate
CID 113207244
5-chloro-N-(2,5-dimethylphenyl)-1H-indole-2-carboxamide
CID 113207220
N-(5-chloro-2-methoxyphenyl)-4-iodobenzamide
CID 1047673
N'-(5-chloro-2-methoxybenzoyl)-5-fluoro-1H-indole-2-carbohydrazide
CID 39977758
5-chloro-N-[4-(propan-2-ylcarbamoylamino)phenyl]-1H-indole-2-carboxamide
CID 134002786
5-chloro-N-[1-(2,4-dimethoxyphenyl)ethyl]-1H-indole-2-carboxamide
CID 55579430
5-chloro-N-(3,4-difluorophenyl)-1H-indole-2-carboxamide
CID 113207264
5-chloro-N-(3-methoxypropyl)-1H-indole-2-carboxamide
CID 4897321

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide?
The IUPAC name of 5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide (CID 113207229) is 5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide?
The canonical SMILES for 5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide is COc1ccc(Cl)cc1NC(=O)c1cc2cc(Cl)ccc2[nH]1.
What is the InChIKey of 5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide?
The InChIKey is WYIPUMFBXLYUQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Cl2N2O2/c1-22-15-5-3-11(18)8-13(15)20-16(21)14-7-9-6-10(17)2-4-12(9)19-14/h2-8,19H,1H3,(H,20,21).
What are the key properties of 5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide?
5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide has a molecular weight of 335.19 g/mol, XLogP of 4.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 113207229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).