4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine

C7H4BrClN2 — CID 142474950

IUPAC4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine
SMILESClc1ncc2[nH]ccc2c1Br
InChIInChI=1S/C7H4BrClN2/c8-6-4-1-2-10-5(4)3-11-7(6)9/h1-3,10H
InChIKeyCILKKCJGJXWRJO-UHFFFAOYSA-N
MW231.48 g/mol
LogP2.98
Rot. Bonds

About 4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine

4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine (PubChem CID 142474950) has the molecular formula C7H4BrClN2 and a molecular weight of 231.48 g/mol. Its IUPAC name is 4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine
PubChem CID142474950
Molecular FormulaC7H4BrClN2
Molecular Weight231.48 g/mol
Exact Mass229.92
IUPAC Name4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine
SMILESClc1ncc2[nH]ccc2c1Br
InChIInChI=1S/C7H4BrClN2/c8-6-4-1-2-10-5(4)3-11-7(6)9/h1-3,10H
InChIKeyCILKKCJGJXWRJO-UHFFFAOYSA-N
XLogP2.98
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.48
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

4-bromo-5-chloro-1H-pyrazolo[3,4-c]pyridine
CID 142474937
4-chloro-1H-pyrrolo[3,2-c]pyridin-7-ol
CID 171482939
5-fluoro-N-methyl-1H-pyrrolo[2,3-c]pyridin-4-amine
CID 167269509
4-chloro-1H-pyrrolo[3,2-c]pyridin-6-amine
CID 123538306
methyl 5-[(4-bromo-1H-pyrrolo[2,3-c]pyridin-5-yl)oxy]-2-fluorobenzenecarboximidothioate;hydroiodide
CID 171076524
1H-1,7-naphthyridin-4-one
CID 589687
4-methyl-1H-pyrrolo[2,3-c]pyridine;molecular hydrogen
CID 163390564
4-bromo-1H-pyrrolo[2,3-c]pyridine;4-bromo-1H-pyrrolo[2,3-c]pyridine-7-carbonitrile
CID 162199854
7-bromo-3H-pyrrolo[2,3-c]isoquinoline
CID 90046653
4-[(4-bromo-6-fluoro-1H-indol-5-yl)sulfanyl]pyridine-2-carbonitrile
CID 171077193
(3-bromo-2-chloro-4-pyridinyl)-trimethylsilane
CID 71419940
6-chloro-4-methyl-1H-pyrrolo[3,2-c]pyridine
CID 74888573

Frequently Asked Questions

What is the IUPAC name of 4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine (CID 142474950) is 4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine is Clc1ncc2[nH]ccc2c1Br.
What is the InChIKey of 4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine?
The InChIKey is CILKKCJGJXWRJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4BrClN2/c8-6-4-1-2-10-5(4)3-11-7(6)9/h1-3,10H.
What are the key properties of 4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine?
4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine has a molecular weight of 231.48 g/mol, XLogP of 2.98, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-5-chloro-1H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 142474950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).