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

C7H4BrClN2 — CID 59693790

IUPAC7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine
SMILESClc1cnc(Br)c2[nH]ccc12
InChIInChI=1S/C7H4BrClN2/c8-7-6-4(1-2-10-6)5(9)3-11-7/h1-3,10H
InChIKeyUDKUOXRKQJWILR-UHFFFAOYSA-N
MW231.48 g/mol
LogP2.98
Rot. Bonds

About 7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine

7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine (PubChem CID 59693790) has the molecular formula C7H4BrClN2 and a molecular weight of 231.48 g/mol. Its IUPAC name is 7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine
PubChem CID59693790
Molecular FormulaC7H4BrClN2
Molecular Weight231.48 g/mol
Exact Mass229.92
IUPAC Name7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine
SMILESClc1cnc(Br)c2[nH]ccc12
InChIInChI=1S/C7H4BrClN2/c8-7-6-4(1-2-10-6)5(9)3-11-7/h1-3,10H
InChIKeyUDKUOXRKQJWILR-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

6-Azaindole
CID 9219
6-bromo-3-chloro-1H-indole
CID 12269921
4-chloro-1H-pyrrolo[3,2-c]pyridine
CID 14114384
4,6-Dichloro-1H-pyrrolo[3,2-c]pyridine
CID 5358988
3-(3-chloro-4-pyridinyl)-1H-pyrrolo[2,3-c]pyridine
CID 137650185
4-Bromo-7-chloro-1H-pyrrolo(2,3-c)pyridine
CID 11031723
7-Chloro-1H-pyrrolo[2,3-c]pyridine
CID 11435048
5-Chloro-1H-pyrrolo(3,2-b)pyridine
CID 12384237
3-Bromo-1H-pyrrolo[2,3-c]pyridine
CID 12410856
4-Bromo-1H-pyrrolo(2,3-c)pyridine
CID 12510055
6-Chloro-1H-pyrrolo(3,2-c)pyridine
CID 12575516
5-chloro-1H-pyrrolo[2,3-c]pyridine
CID 14822070

Frequently Asked Questions

What is the IUPAC name of 7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine (CID 59693790) is 7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine is Clc1cnc(Br)c2[nH]ccc12.
What is the InChIKey of 7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine?
The InChIKey is UDKUOXRKQJWILR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4BrClN2/c8-7-6-4(1-2-10-6)5(9)3-11-7/h1-3,10H.
What are the key properties of 7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine?
7-bromo-4-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 7-bromo-4-chloro-1H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 59693790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).