6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide

C15H10Br2N2O — CID 175535404

IUPAC6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide
SMILESO=C(Nc1cccc(Br)c1)c1cc2ccc(Br)cc2[nH]1
InChIInChI=1S/C15H10Br2N2O/c16-10-2-1-3-12(7-10)18-15(20)14-6-9-4-5-11(17)8-13(9)19-14/h1-8,19H,(H,18,20)
InChIKeySHSCCCSVCJIKCI-UHFFFAOYSA-N
MW394.07 g/mol
LogP4.95
Rot. Bonds2

About 6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide

6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide (PubChem CID 175535404) has the molecular formula C15H10Br2N2O and a molecular weight of 394.07 g/mol. Its IUPAC name is 6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide
PubChem CID175535404
Molecular FormulaC15H10Br2N2O
Molecular Weight394.07 g/mol
Exact Mass391.92
IUPAC Name6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide
SMILESO=C(Nc1cccc(Br)c1)c1cc2ccc(Br)cc2[nH]1
InChIInChI=1S/C15H10Br2N2O/c16-10-2-1-3-12(7-10)18-15(20)14-6-9-4-5-11(17)8-13(9)19-14/h1-8,19H,(H,18,20)
InChIKeySHSCCCSVCJIKCI-UHFFFAOYSA-N
XLogP4.95
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.07
LogP ≤ 54.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

6-bromo-N-(2-hydroxy-3-methylphenyl)-1H-indole-2-carboxamide
CID 159678407
N-[3-(3-bromophenyl)sulfonylphenyl]-6-(methanesulfonamido)-1H-indole-2-carboxamide
CID 86762816
6-bromo-N-(2-fluorophenyl)-1H-indole-2-carboxamide
CID 47155114
6-bromo-N-[(3-bromophenyl)methyl]-1H-indole-2-carboxamide
CID 175535401
N-[4-(2-amino-2-oxoethyl)phenyl]-6-bromo-1H-indole-2-carboxamide
CID 31861888
N-(4-bromophenyl)-6-chloro-1H-indole-2-carboxamide
CID 113207573
6-bromo-N-[3-chloro-4-(cyclopropylcarbamoyl)phenyl]-1H-indole-2-carboxamide
CID 55969655
6-bromo-N-[3-[(2-carbamoylpyrrolidin-1-yl)methyl]phenyl]-1H-indole-2-carboxamide
CID 55983762
methyl 3-[(6-methyl-1H-indole-2-carbonyl)amino]benzoate
CID 113207378
6-bromo-N-pyrazin-2-yl-1H-indole-2-carboxamide
CID 137381836
N-(3-methoxyphenyl)-6-methyl-1H-indole-2-carboxamide
CID 113207365
6-bromo-N-(5-carbamoyl-3-fluoro-2-methylphenyl)-1H-indole-2-carboxamide
CID 87045715

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide?
The IUPAC name of 6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide (CID 175535404) is 6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide?
The canonical SMILES for 6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide is O=C(Nc1cccc(Br)c1)c1cc2ccc(Br)cc2[nH]1.
What is the InChIKey of 6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide?
The InChIKey is SHSCCCSVCJIKCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Br2N2O/c16-10-2-1-3-12(7-10)18-15(20)14-6-9-4-5-11(17)8-13(9)19-14/h1-8,19H,(H,18,20).
What are the key properties of 6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide?
6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide has a molecular weight of 394.07 g/mol, XLogP of 4.95, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(3-bromophenyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 175535404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).