2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine

C10H11BrN4 — CID 64610224

IUPAC2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine
SMILESBrc1cnc2nc(CC3CNC3)[nH]c2c1
InChIInChI=1S/C10H11BrN4/c11-7-2-8-10(13-5-7)15-9(14-8)1-6-3-12-4-6/h2,5-6,12H,1,3-4H2,(H,13,14,15)
InChIKeyMPGKCMIKMMWCLQ-UHFFFAOYSA-N
MW267.13 g/mol
LogP1.48
Rot. Bonds2

About 2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine

2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine (PubChem CID 64610224) has the molecular formula C10H11BrN4 and a molecular weight of 267.13 g/mol. Its IUPAC name is 2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine
PubChem CID64610224
Molecular FormulaC10H11BrN4
Molecular Weight267.13 g/mol
Exact Mass266.02
IUPAC Name2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine
SMILESBrc1cnc2nc(CC3CNC3)[nH]c2c1
InChIInChI=1S/C10H11BrN4/c11-7-2-8-10(13-5-7)15-9(14-8)1-6-3-12-4-6/h2,5-6,12H,1,3-4H2,(H,13,14,15)
InChIKeyMPGKCMIKMMWCLQ-UHFFFAOYSA-N
XLogP1.48
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.13
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Imidazo(4,5-b)pyridine
CID 67504
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
3H-Imidazo(4,5-b)pyridin-2-amine
CID 179897
H4R antagonist 1
CID 71548412
6-bromo-2-methyl-1H-imidazo(4,5-b)pyridine
CID 1958572
3-Deazaadenine
CID 418745
3H-imidazo(4,5-b)pyridin-7-amine
CID 3879010
(1H-Imidazo(4,5-B)Pyridin-2-Yl)Methanamine
CID 17747911
1-[2-(1H-benzimidazol-2-yl)ethyl]-3-(5-bromo-2-pyridyl)thiourea
CID 3001143
6-(4-bromophenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 6538777

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine (CID 64610224) is 2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine is Brc1cnc2nc(CC3CNC3)[nH]c2c1.
What is the InChIKey of 2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine?
The InChIKey is MPGKCMIKMMWCLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN4/c11-7-2-8-10(13-5-7)15-9(14-8)1-6-3-12-4-6/h2,5-6,12H,1,3-4H2,(H,13,14,15).
What are the key properties of 2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine?
2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine has a molecular weight of 267.13 g/mol, XLogP of 1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-ylmethyl)-6-bromo-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 64610224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).