2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine

C16H17N3 — CID 129215296

IUPAC2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine
SMILESCc1ccc(-c2nc3cc(C)cnc3n2C)c(C)c1
InChIInChI=1S/C16H17N3/c1-10-5-6-13(12(3)7-10)15-18-14-8-11(2)9-17-16(14)19(15)4/h5-9H,1-4H3
InChIKeyVEFXFKCVPYMPDY-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.56
Rot. Bonds1

About 2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine

2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine (PubChem CID 129215296) has the molecular formula C16H17N3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine
PubChem CID129215296
Molecular FormulaC16H17N3
Molecular Weight251.33 g/mol
Exact Mass251.14
IUPAC Name2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine
SMILESCc1ccc(-c2nc3cc(C)cnc3n2C)c(C)c1
InChIInChI=1S/C16H17N3/c1-10-5-6-13(12(3)7-10)15-18-14-8-11(2)9-17-16(14)19(15)4/h5-9H,1-4H3
InChIKeyVEFXFKCVPYMPDY-UHFFFAOYSA-N
XLogP3.56
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-ethynyl-4-pyridinyl)-3,6-dimethylimidazo[4,5-b]pyridine
CID 58056866
2-chloro-3,6-dimethylimidazo[4,5-b]pyridine
CID 14929597
3,6-dimethyl-2-[3-(trifluoromethylsulfanyl)-4-pyridinyl]imidazo[4,5-b]pyridine
CID 58056791
2-(3-ethylsulfinyl-4-pyridinyl)-3,6-dimethylimidazo[4,5-b]pyridine
CID 58056806
3-(2,5-dimethylphenyl)-6-methylimidazo[4,5-b]pyridin-2-amine
CID 79301322
5-(2,4-dimethylphenyl)-2-methylpyrimidin-4-amine
CID 82284415
3-[6-methyl-2-(2-methylphenyl)imidazo[4,5-b]pyridin-3-yl]propanoic acid
CID 82061512
2-(2,4-dimethylphenyl)-1-[2-(4-methoxyphenoxy)ethyl]benzimidazole
CID 16987578
2-(2,4-dimethylphenyl)-1-[3-(3-methylphenoxy)propyl]benzimidazole
CID 16987594
2-(2,4-dimethylphenyl)-1-prop-2-enylbenzimidazole
CID 16987511
2-[2-(3,4-dimethylphenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]ethanol
CID 82150776
2-(2-fluorophenyl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine
CID 67981840

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine?
The IUPAC name of 2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine (CID 129215296) is 2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine?
The canonical SMILES for 2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine is Cc1ccc(-c2nc3cc(C)cnc3n2C)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine?
The InChIKey is VEFXFKCVPYMPDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3/c1-10-5-6-13(12(3)7-10)15-18-14-8-11(2)9-17-16(14)19(15)4/h5-9H,1-4H3.
What are the key properties of 2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine?
2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine has a molecular weight of 251.33 g/mol, XLogP of 3.56, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenyl)-3,6-dimethylimidazo[4,5-b]pyridine is sourced from PubChem (CID 129215296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).