N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide

C15H10BrClN2O — CID 43582829

IUPACN-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide
SMILESO=C(Nc1ccc(Br)cc1Cl)c1cccc2[nH]ccc12
InChIInChI=1S/C15H10BrClN2O/c16-9-4-5-14(12(17)8-9)19-15(20)11-2-1-3-13-10(11)6-7-18-13/h1-8,18H,(H,19,20)
InChIKeyHCZKNLJOTVMSKP-UHFFFAOYSA-N
MW349.62 g/mol
LogP4.84
Rot. Bonds2

About N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide

N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide (PubChem CID 43582829) has the molecular formula C15H10BrClN2O and a molecular weight of 349.62 g/mol. Its IUPAC name is N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide
PubChem CID43582829
Molecular FormulaC15H10BrClN2O
Molecular Weight349.62 g/mol
Exact Mass347.97
IUPAC NameN-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide
SMILESO=C(Nc1ccc(Br)cc1Cl)c1cccc2[nH]ccc12
InChIInChI=1S/C15H10BrClN2O/c16-9-4-5-14(12(17)8-9)19-15(20)11-2-1-3-13-10(11)6-7-18-13/h1-8,18H,(H,19,20)
InChIKeyHCZKNLJOTVMSKP-UHFFFAOYSA-N
XLogP4.84
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.62
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,6-dichlorophenyl)-1H-indole-4-carboxamide
CID 65499059
N-(4-bromo-2,6-dimethylphenyl)-1H-indole-4-carboxamide
CID 43582014
N-(5-bromo-2-pyridinyl)-1H-indole-4-carboxamide
CID 43583044
N-(3-chloro-4-methylphenyl)-1H-indole-4-carboxamide
CID 43582392
N-(4-chloro-3-fluorophenyl)-1H-indole-4-carboxamide
CID 61274358
N-(4-bromo-3,5-dimethylphenyl)-1H-indole-4-carboxamide
CID 107575074
2-amino-N-(4-bromo-2-chlorophenyl)-3-methylbenzamide
CID 43347143
4-bromo-N-(4-bromo-2-chlorophenyl)-2-hydroxybenzamide
CID 63524501
N-(3-bromo-4-fluorophenyl)-1H-indole-4-carboxamide
CID 115672322
N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide
CID 43582640
5-amino-N-(4-bromo-2-chlorophenyl)-2-chlorobenzamide
CID 43347151
N-(5-chloro-2-pyridinyl)-1H-indole-4-carboxamide
CID 43583034

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide?
The IUPAC name of N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide (CID 43582829) is N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide.
What is the SMILES notation for N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide?
The canonical SMILES for N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide is O=C(Nc1ccc(Br)cc1Cl)c1cccc2[nH]ccc12.
What is the InChIKey of N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide?
The InChIKey is HCZKNLJOTVMSKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrClN2O/c16-9-4-5-14(12(17)8-9)19-15(20)11-2-1-3-13-10(11)6-7-18-13/h1-8,18H,(H,19,20).
What are the key properties of N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide?
N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide has a molecular weight of 349.62 g/mol, XLogP of 4.84, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-chlorophenyl)-1H-indole-4-carboxamide is sourced from PubChem (CID 43582829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).