N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide

C15H12BrN3O — CID 79049257

IUPACN-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide
SMILESCc1nc(NC(=O)c2cc3ccccc3[nH]2)ccc1Br
InChIInChI=1S/C15H12BrN3O/c1-9-11(16)6-7-14(17-9)19-15(20)13-8-10-4-2-3-5-12(10)18-13/h2-8,18H,1H3,(H,17,19,20)
InChIKeyPKWQZCZLQAQAHB-UHFFFAOYSA-N
MW330.19 g/mol
LogP3.89
Rot. Bonds2

About N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide

N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide (PubChem CID 79049257) has the molecular formula C15H12BrN3O and a molecular weight of 330.19 g/mol. Its IUPAC name is N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide
PubChem CID79049257
Molecular FormulaC15H12BrN3O
Molecular Weight330.19 g/mol
Exact Mass329.02
IUPAC NameN-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide
SMILESCc1nc(NC(=O)c2cc3ccccc3[nH]2)ccc1Br
InChIInChI=1S/C15H12BrN3O/c1-9-11(16)6-7-14(17-9)19-15(20)13-8-10-4-2-3-5-12(10)18-13/h2-8,18H,1H3,(H,17,19,20)
InChIKeyPKWQZCZLQAQAHB-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

N-(5-bromo-6-methyl-2-pyridinyl)-5-ethyl-1H-indole-2-carboxamide
CID 2823644
N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide
CID 102674192
N-(5-bromo-6-methyl-2-pyridinyl)-4-chloro-1H-pyrrole-2-carboxamide
CID 79049259
N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxybenzamide
CID 79049112
4-bromo-N-(5-bromo-6-methyl-2-pyridinyl)benzamide
CID 4509258
N-(5-bromo-2,4-difluorophenyl)-1H-indole-2-carboxamide
CID 102854713
N-pyrazin-2-yl-1H-indole-2-carboxamide
CID 43422742
N-(6-bromo-3-pyridinyl)-1H-indole-2-carboxamide
CID 103789422
N-(3-methyl-1,2,4-oxadiazol-5-yl)-1H-indole-2-carboxamide
CID 115587298
N-(5-bromo-6-methyl-2-pyridinyl)-2,4,6-trimethylbenzamide
CID 79048667
N-(5-bromo-1,3-thiazol-2-yl)-1H-indole-2-carboxamide
CID 60784651
N-(5-bromo-6-methyl-2-pyridinyl)-2,3-dihydroxybenzamide
CID 114343707

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide?
The IUPAC name of N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide (CID 79049257) is N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide is Cc1nc(NC(=O)c2cc3ccccc3[nH]2)ccc1Br.
What is the InChIKey of N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide?
The InChIKey is PKWQZCZLQAQAHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN3O/c1-9-11(16)6-7-14(17-9)19-15(20)13-8-10-4-2-3-5-12(10)18-13/h2-8,18H,1H3,(H,17,19,20).
What are the key properties of N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide?
N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-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-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 79049257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).