4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine

C7H6BrN3 — CID 67382285

IUPAC4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine
SMILESNc1ncc2[nH]ccc2c1Br
InChIInChI=1S/C7H6BrN3/c8-6-4-1-2-10-5(4)3-11-7(6)9/h1-3,10H,(H2,9,11)
InChIKeyIZDMCCNKFUKBDD-UHFFFAOYSA-N
MW212.05 g/mol
LogP1.91
Rot. Bonds

About 4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine

4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine (PubChem CID 67382285) has the molecular formula C7H6BrN3 and a molecular weight of 212.05 g/mol. Its IUPAC name is 4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine.

Molecular Properties

Compound Name4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine
PubChem CID67382285
Molecular FormulaC7H6BrN3
Molecular Weight212.05 g/mol
Exact Mass210.97
IUPAC Name4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine
SMILESNc1ncc2[nH]ccc2c1Br
InChIInChI=1S/C7H6BrN3/c8-6-4-1-2-10-5(4)3-11-7(6)9/h1-3,10H,(H2,9,11)
InChIKeyIZDMCCNKFUKBDD-UHFFFAOYSA-N
XLogP1.91
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.05
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-Azaindole
CID 9219
6-bromo-1H-pyrrolo[3,2-b]pyridin-5-amine
CID 92130857
6-Bromo-4-azabenzimidazole
CID 911578
3H-Imidazo(4,5-b)pyridine, 6-bromo-5-methyl-
CID 5310884
5-bromo-1H-pyrrolo[2,3-b]pyridine
CID 10307932
1H-pyrrolo[3,2-b]pyridin-5-amine
CID 22126239
6-bromo-2-methyl-1H-imidazo(4,5-b)pyridine
CID 1958572
3-Bromo-1H-pyrrolo[2,3-b]pyridine
CID 5523659
4-Bromo-1H-pyrrolo[2,3-b]pyridine
CID 22273643
2-(2-amino-4-pyridinyl)-6-bromo-N-methyl-1H-imidazo[4,5-b]pyridin-7-amine
CID 70695756
4-(6-bromo-3H-imidazo[4,5-b]pyridin-2-yl)-N,N-dimethylbenzenamine
CID 44433683
6-Methyl-1H-pyrrolo[3,2-b]pyridin-5-amine
CID 142405777

Frequently Asked Questions

What is the IUPAC name of 4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine?
The IUPAC name of 4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine (CID 67382285) is 4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine.
What is the SMILES notation for 4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine?
The canonical SMILES for 4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine is Nc1ncc2[nH]ccc2c1Br.
What is the InChIKey of 4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine?
The InChIKey is IZDMCCNKFUKBDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrN3/c8-6-4-1-2-10-5(4)3-11-7(6)9/h1-3,10H,(H2,9,11).
What are the key properties of 4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine?
4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine has a molecular weight of 212.05 g/mol, XLogP of 1.91, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1H-pyrrolo[2,3-c]pyridin-5-amine is sourced from PubChem (CID 67382285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).