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

C14H10BrN3O — CID 102674192

IUPACN-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide
SMILESO=C(Nc1cc(Br)ccn1)c1cc2ccccc2[nH]1
InChIInChI=1S/C14H10BrN3O/c15-10-5-6-16-13(8-10)18-14(19)12-7-9-3-1-2-4-11(9)17-12/h1-8,17H,(H,16,18,19)
InChIKeySOJKONRGUBLGQD-UHFFFAOYSA-N
MW316.16 g/mol
LogP3.58
Rot. Bonds2

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

N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide (PubChem CID 102674192) has the molecular formula C14H10BrN3O and a molecular weight of 316.16 g/mol. Its IUPAC name is N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide
PubChem CID102674192
Molecular FormulaC14H10BrN3O
Molecular Weight316.16 g/mol
Exact Mass315.00
IUPAC NameN-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide
SMILESO=C(Nc1cc(Br)ccn1)c1cc2ccccc2[nH]1
InChIInChI=1S/C14H10BrN3O/c15-10-5-6-16-13(8-10)18-14(19)12-7-9-3-1-2-4-11(9)17-12/h1-8,17H,(H,16,18,19)
InChIKeySOJKONRGUBLGQD-UHFFFAOYSA-N
XLogP3.58
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.16
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-pyrazin-2-yl-1H-indole-2-carboxamide
CID 43422742
N-(5-bromo-6-methyl-2-pyridinyl)-1H-indole-2-carboxamide
CID 79049257
6-bromo-N-pyrazin-2-yl-1H-indole-2-carboxamide
CID 137381836
N-(6-bromo-3-pyridinyl)-1H-indole-2-carboxamide
CID 103789422
N-(4-bromo-2-pyridinyl)-2-oxo-1H-quinoline-4-carboxamide
CID 102674190
N-(5-bromo-1,3-thiazol-2-yl)-1H-indole-2-carboxamide
CID 60784651
N-(1-methylimidazol-2-yl)-1H-indole-2-carboxamide
CID 110474026
N-(5-bromo-2,4-difluorophenyl)-1H-indole-2-carboxamide
CID 102854713
N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide
CID 67552245
N-(4-bromo-2-pyridinyl)furan-2-carboxamide
CID 102674239
N-[(4-bromophenyl)methyl]-1H-indole-2-carboxamide
CID 46921176
potassium N-oxido-1H-indole-2-carboxamide
CID 23661896

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide?
The IUPAC name of N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide (CID 102674192) is N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide is O=C(Nc1cc(Br)ccn1)c1cc2ccccc2[nH]1.
What is the InChIKey of N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide?
The InChIKey is SOJKONRGUBLGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrN3O/c15-10-5-6-16-13(8-10)18-14(19)12-7-9-3-1-2-4-11(9)17-12/h1-8,17H,(H,16,18,19).
What are the key properties of N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide?
N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide has a molecular weight of 316.16 g/mol, XLogP of 3.58, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 102674192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).