N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide

C15H10BrClN2O — CID 113207573

IUPACN-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide
SMILESO=C(Nc1ccc(Br)cc1)c1cc2ccc(Cl)cc2[nH]1
InChIInChI=1S/C15H10BrClN2O/c16-10-2-5-12(6-3-10)18-15(20)14-7-9-1-4-11(17)8-13(9)19-14/h1-8,19H,(H,18,20)
InChIKeyZIDSMVIOWAGPRM-UHFFFAOYSA-N
MW349.62 g/mol
LogP4.84
Rot. Bonds2

About N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide

N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide (PubChem CID 113207573) has the molecular formula C15H10BrClN2O and a molecular weight of 349.62 g/mol. Its IUPAC name is N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide
PubChem CID113207573
Molecular FormulaC15H10BrClN2O
Molecular Weight349.62 g/mol
Exact Mass347.97
IUPAC NameN-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide
SMILESO=C(Nc1ccc(Br)cc1)c1cc2ccc(Cl)cc2[nH]1
InChIInChI=1S/C15H10BrClN2O/c16-10-2-5-12(6-3-10)18-15(20)14-7-9-1-4-11(17)8-13(9)19-14/h1-8,19H,(H,18,20)
InChIKeyZIDSMVIOWAGPRM-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

6-chloro-N-(4-cyanophenyl)-1H-indole-2-carboxamide
CID 113207612
6-chloro-N-(4-propan-2-yloxyphenyl)-1H-indole-2-carboxamide
CID 113207580
N-[4-(2-amino-2-oxoethyl)phenyl]-6-chloro-1H-indole-2-carboxamide
CID 31862421
ethyl N-[4-[(6-chloro-1H-indole-2-carbonyl)amino]phenyl]carbamate
CID 60515896
6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide
CID 175535404
N-[4-(2-amino-2-oxoethyl)phenyl]-6-bromo-1H-indole-2-carboxamide
CID 31861888
N-(3-chloro-4-fluorophenyl)-6-fluoro-1H-indole-2-carboxamide
CID 113207472
N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide
CID 108791596
6-bromo-N-[3-chloro-4-(cyclopropylcarbamoyl)phenyl]-1H-indole-2-carboxamide
CID 55969655
6-chloro-N-ethyl-1H-indole-2-carboxamide
CID 47172452
5-chloro-N-(3,4-difluorophenyl)-1H-indole-2-carboxamide
CID 113207264
6-chloro-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-1H-indole-2-carboxamide
CID 55842402

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide?
The IUPAC name of N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide (CID 113207573) is N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide.
What is the SMILES notation for N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide?
The canonical SMILES for N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide is O=C(Nc1ccc(Br)cc1)c1cc2ccc(Cl)cc2[nH]1.
What is the InChIKey of N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide?
The InChIKey is ZIDSMVIOWAGPRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrClN2O/c16-10-2-5-12(6-3-10)18-15(20)14-7-9-1-4-11(17)8-13(9)19-14/h1-8,19H,(H,18,20).
What are the key properties of N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide?
N-(4-bromophenyl)-6-chloro-1H-indole-2-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-bromophenyl)-6-chloro-1H-indole-2-carboxamide is sourced from PubChem (CID 113207573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).