2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine

C7H6ClN3 — CID 122362438

IUPAC2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(Cl)[nH]c2c1
InChIInChI=1S/C7H6ClN3/c1-4-2-5-6(9-3-4)11-7(8)10-5/h2-3H,1H3,(H,9,10,11)
InChIKeyXAXMRTQZRHDPDP-UHFFFAOYSA-N
MW167.60 g/mol
LogP1.92
Rot. Bonds

About 2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine

2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine (PubChem CID 122362438) has the molecular formula C7H6ClN3 and a molecular weight of 167.60 g/mol. Its IUPAC name is 2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine
PubChem CID122362438
Molecular FormulaC7H6ClN3
Molecular Weight167.60 g/mol
Exact Mass167.03
IUPAC Name2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(Cl)[nH]c2c1
InChIInChI=1S/C7H6ClN3/c1-4-2-5-6(9-3-4)11-7(8)10-5/h2-3H,1H3,(H,9,10,11)
InChIKeyXAXMRTQZRHDPDP-UHFFFAOYSA-N
XLogP1.92
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.60
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine (CID 122362438) is 2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine is Cc1cnc2nc(Cl)[nH]c2c1.
What is the InChIKey of 2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is XAXMRTQZRHDPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN3/c1-4-2-5-6(9-3-4)11-7(8)10-5/h2-3H,1H3,(H,9,10,11).
What are the key properties of 2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine?
2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 167.60 g/mol, XLogP of 1.92, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 122362438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).