N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide

C15H12BrN3O — CID 79733331

IUPACN-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide
SMILESCc1cc(NC(=O)c2cccc3cc[nH]c23)ncc1Br
InChIInChI=1S/C15H12BrN3O/c1-9-7-13(18-8-12(9)16)19-15(20)11-4-2-3-10-5-6-17-14(10)11/h2-8,17H,1H3,(H,18,19,20)
InChIKeyRPWHASHKWGFKDL-UHFFFAOYSA-N
MW330.19 g/mol
LogP3.89
Rot. Bonds2

About N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide

N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide (PubChem CID 79733331) has the molecular formula C15H12BrN3O and a molecular weight of 330.19 g/mol. Its IUPAC name is N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide
PubChem CID79733331
Molecular FormulaC15H12BrN3O
Molecular Weight330.19 g/mol
Exact Mass329.02
IUPAC NameN-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide
SMILESCc1cc(NC(=O)c2cccc3cc[nH]c23)ncc1Br
InChIInChI=1S/C15H12BrN3O/c1-9-7-13(18-8-12(9)16)19-15(20)11-4-2-3-10-5-6-17-14(10)11/h2-8,17H,1H3,(H,18,19,20)
InChIKeyRPWHASHKWGFKDL-UHFFFAOYSA-N
XLogP3.89
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.19
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-(5-bromo-4-methyl-2-pyridinyl)-3-methylbenzamide
CID 113339789
N-(5-bromo-4-methyl-2-pyridinyl)-3-chloro-2-methylbenzamide
CID 107096916
N-(2-methyl-3-pyridinyl)-1H-indole-7-carboxamide
CID 79044351
N-(5-bromo-4-methyl-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide
CID 79730155
N-(5-bromo-4-methyl-2-pyridinyl)-2-nitrobenzamide
CID 79733435
N-(5-bromo-4-methyl-2-pyridinyl)-2-fluoro-5-methylbenzamide
CID 79733422
N-(5-bromo-4-methyl-2-pyridinyl)-2,5-dimethoxybenzamide
CID 79736443
N-(5-bromo-4-methyl-2-pyridinyl)-4-chloropyridine-3-carboxamide
CID 81232858
N-(5-bromo-4-methyl-2-pyridinyl)-3,6-dimethylpyridazine-4-carboxamide
CID 112548436
N-(5-bromo-4-methyl-2-pyridinyl)-2,6-difluoro-3-methylbenzamide
CID 82814313
N-(5-bromo-4-methyl-2-pyridinyl)-4-(methylamino)pyridine-3-carboxamide
CID 81245636
6-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-3-carboxamide
CID 79735745

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide?
The IUPAC name of N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide (CID 79733331) is N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide.
What is the SMILES notation for N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide?
The canonical SMILES for N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide is Cc1cc(NC(=O)c2cccc3cc[nH]c23)ncc1Br.
What is the InChIKey of N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide?
The InChIKey is RPWHASHKWGFKDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN3O/c1-9-7-13(18-8-12(9)16)19-15(20)11-4-2-3-10-5-6-17-14(10)11/h2-8,17H,1H3,(H,18,19,20).
What are the key properties of N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide?
N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide has a molecular weight of 330.19 g/mol, XLogP of 3.89, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-7-carboxamide is sourced from PubChem (CID 79733331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).