N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide

C15H10BrClN2O — CID 108791596

IUPACN-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide
SMILESO=C(Nc1ccc(Br)cc1)c1cc2cccc(Cl)c2[nH]1
InChIInChI=1S/C15H10BrClN2O/c16-10-4-6-11(7-5-10)18-15(20)13-8-9-2-1-3-12(17)14(9)19-13/h1-8,19H,(H,18,20)
InChIKeyPJKAFAFWKBFWDD-UHFFFAOYSA-N
MW349.62 g/mol
LogP4.84
Rot. Bonds2

About N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide

N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide (PubChem CID 108791596) has the molecular formula C15H10BrClN2O and a molecular weight of 349.62 g/mol. Its IUPAC name is N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide
PubChem CID108791596
Molecular FormulaC15H10BrClN2O
Molecular Weight349.62 g/mol
Exact Mass347.97
IUPAC NameN-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide
SMILESO=C(Nc1ccc(Br)cc1)c1cc2cccc(Cl)c2[nH]1
InChIInChI=1S/C15H10BrClN2O/c16-10-4-6-11(7-5-10)18-15(20)13-8-9-2-1-3-12(17)14(9)19-13/h1-8,19H,(H,18,20)
InChIKeyPJKAFAFWKBFWDD-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

7-chloro-N-naphthalen-2-yl-1H-indole-2-carboxamide
CID 108791741
7-chloro-N-(4-cyanophenyl)-1H-indole-2-carboxamide
CID 108791683
7-chloro-N-(3-chloro-4-methoxyphenyl)-1H-indole-2-carboxamide
CID 108791613
7-chloro-N-[3-(dimethylamino)phenyl]-1H-indole-2-carboxamide
CID 108791753
7-chloro-1H-indole-2-carbohydrazide
CID 13466352
7-chloro-N-[4-[(4-chlorophenyl)methoxy]phenyl]-1H-indole-2-carboxamide
CID 108791740
7-chloro-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-1H-indole-2-carboxamide
CID 108791703
7-amino-N-(4-chlorophenyl)-1H-indole-2-carboxamide
CID 63117531
7-chloro-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-1H-indole-2-carboxamide
CID 108791702
7-chloro-N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-1H-indole-2-carboxamide
CID 108791770
7-chloro-N-(2,6-diethylphenyl)-1H-indole-2-carboxamide
CID 108791658
N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide
CID 113207573

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide?
The IUPAC name of N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide (CID 108791596) is N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide.
What is the SMILES notation for N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide?
The canonical SMILES for N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide is O=C(Nc1ccc(Br)cc1)c1cc2cccc(Cl)c2[nH]1.
What is the InChIKey of N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide?
The InChIKey is PJKAFAFWKBFWDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrClN2O/c16-10-4-6-11(7-5-10)18-15(20)13-8-9-2-1-3-12(17)14(9)19-13/h1-8,19H,(H,18,20).
What are the key properties of N-(4-bromophenyl)-7-chloro-1H-indole-2-carboxamide?
N-(4-bromophenyl)-7-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)-7-chloro-1H-indole-2-carboxamide is sourced from PubChem (CID 108791596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).