7-bromo-3-cyclopropylimidazo[4,5-b]pyridine

C9H8BrN3 — CID 84700561

IUPAC7-bromo-3-cyclopropylimidazo[4,5-b]pyridine
SMILESBrc1ccnc2c1ncn2C1CC1
InChIInChI=1S/C9H8BrN3/c10-7-3-4-11-9-8(7)12-5-13(9)6-1-2-6/h3-6H,1-2H2
InChIKeyDZLFQRKOBKZDOD-UHFFFAOYSA-N
MW238.09 g/mol
LogP2.53
Rot. Bonds1

About 7-bromo-3-cyclopropylimidazo[4,5-b]pyridine

7-bromo-3-cyclopropylimidazo[4,5-b]pyridine (PubChem CID 84700561) has the molecular formula C9H8BrN3 and a molecular weight of 238.09 g/mol. Its IUPAC name is 7-bromo-3-cyclopropylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name7-bromo-3-cyclopropylimidazo[4,5-b]pyridine
PubChem CID84700561
Molecular FormulaC9H8BrN3
Molecular Weight238.09 g/mol
Exact Mass236.99
IUPAC Name7-bromo-3-cyclopropylimidazo[4,5-b]pyridine
SMILESBrc1ccnc2c1ncn2C1CC1
InChIInChI=1S/C9H8BrN3/c10-7-3-4-11-9-8(7)12-5-13(9)6-1-2-6/h3-6H,1-2H2
InChIKeyDZLFQRKOBKZDOD-UHFFFAOYSA-N
XLogP2.53
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.09
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopropyl-7-pyrrolidin-2-ylimidazo[4,5-b]pyridine
CID 84691994
9-cyclopropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)purine
CID 154829192
9-cyclopropyl-6-[4-(2-fluoro-4-pyridinyl)piperazin-1-yl]purine
CID 172882518
6-bromo-3-cyclohexyl-7-methylimidazo[4,5-b]pyridine
CID 74789553
6-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-9-cyclopropylpurine
CID 155980660
9-cyclopropyl-6-(3-methylpiperidin-1-yl)purine
CID 163354022
9-cyclopropyl-N-(1,2-thiazol-5-ylmethyl)purin-6-amine
CID 166246142
13-bromo-5-(4-methoxycyclohexyl)-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one
CID 143160268
6-[4-(9-cyclopropylpurin-6-yl)piperazin-1-yl]pyridine-3-carbonitrile
CID 155980578
(2R)-1-(9-cyclopropylpurin-6-yl)pyrrolidine-2-carboxylic acid
CID 122051660
5-[4-(9-cyclopropylpurin-6-yl)piperazin-1-yl]pyridine-2-carbonitrile
CID 155980616
9-cyclopropyl-N-(2,6-dimethylphenyl)purin-6-amine
CID 163344743

Frequently Asked Questions

What is the IUPAC name of 7-bromo-3-cyclopropylimidazo[4,5-b]pyridine?
The IUPAC name of 7-bromo-3-cyclopropylimidazo[4,5-b]pyridine (CID 84700561) is 7-bromo-3-cyclopropylimidazo[4,5-b]pyridine.
What is the SMILES notation for 7-bromo-3-cyclopropylimidazo[4,5-b]pyridine?
The canonical SMILES for 7-bromo-3-cyclopropylimidazo[4,5-b]pyridine is Brc1ccnc2c1ncn2C1CC1.
What is the InChIKey of 7-bromo-3-cyclopropylimidazo[4,5-b]pyridine?
The InChIKey is DZLFQRKOBKZDOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrN3/c10-7-3-4-11-9-8(7)12-5-13(9)6-1-2-6/h3-6H,1-2H2.
What are the key properties of 7-bromo-3-cyclopropylimidazo[4,5-b]pyridine?
7-bromo-3-cyclopropylimidazo[4,5-b]pyridine has a molecular weight of 238.09 g/mol, XLogP of 2.53, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-3-cyclopropylimidazo[4,5-b]pyridine is sourced from PubChem (CID 84700561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).