2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine

C14H19N3 — CID 107180172

IUPAC2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(C3CCCC3(C)C)[nH]c2c1
InChIInChI=1S/C14H19N3/c1-9-7-11-13(15-8-9)17-12(16-11)10-5-4-6-14(10,2)3/h7-8,10H,4-6H2,1-3H3,(H,15,16,17)
InChIKeyZFMNQQMMGRFBNA-UHFFFAOYSA-N
MW229.33 g/mol
LogP3.56
Rot. Bonds1

About 2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine

2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine (PubChem CID 107180172) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine
PubChem CID107180172
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(C3CCCC3(C)C)[nH]c2c1
InChIInChI=1S/C14H19N3/c1-9-7-11-13(15-8-9)17-12(16-11)10-5-4-6-14(10,2)3/h7-8,10H,4-6H2,1-3H3,(H,15,16,17)
InChIKeyZFMNQQMMGRFBNA-UHFFFAOYSA-N
XLogP3.56
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine (CID 107180172) is 2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine is Cc1cnc2nc(C3CCCC3(C)C)[nH]c2c1.
What is the InChIKey of 2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is ZFMNQQMMGRFBNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-9-7-11-13(15-8-9)17-12(16-11)10-5-4-6-14(10,2)3/h7-8,10H,4-6H2,1-3H3,(H,15,16,17).
What are the key properties of 2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine?
2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 229.33 g/mol, XLogP of 3.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylcyclopentyl)-6-methyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 107180172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).