2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine

C21H26FN3O — CID 18001485

IUPAC2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine
SMILESCCc1nc2c(-c3cc(F)c(OC)cc3C)nccc2n1C(CC)CC
InChIInChI=1S/C21H26FN3O/c1-6-14(7-2)25-17-9-10-23-20(21(17)24-19(25)8-3)15-12-16(22)18(26-5)11-13(15)4/h9-12,14H,6-8H2,1-5H3
InChIKeyGHBGOHSUMMSHGX-UHFFFAOYSA-N
MW355.46 g/mol
LogP5.48
Rot. Bonds6

About 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine

2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine (PubChem CID 18001485) has the molecular formula C21H26FN3O and a molecular weight of 355.46 g/mol. Its IUPAC name is 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine
PubChem CID18001485
Molecular FormulaC21H26FN3O
Molecular Weight355.46 g/mol
Exact Mass355.21
IUPAC Name2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine
SMILESCCc1nc2c(-c3cc(F)c(OC)cc3C)nccc2n1C(CC)CC
InChIInChI=1S/C21H26FN3O/c1-6-14(7-2)25-17-9-10-23-20(21(17)24-19(25)8-3)15-12-16(22)18(26-5)11-13(15)4/h9-12,14H,6-8H2,1-5H3
InChIKeyGHBGOHSUMMSHGX-UHFFFAOYSA-N
XLogP5.48
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.46
LogP ≤ 55.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001399
4-(5-fluoro-4-methoxy-2-methylphenyl)-2-methoxy-1-pentan-3-ylimidazo[4,5-c]pyridine
CID 18001531
4-(5-fluoro-4-methoxy-2-methylphenyl)-2-methoxy-1-(1-methoxybutan-2-yl)imidazo[4,5-c]pyridine
CID 18001490
2-ethyl-7-(5-fluoro-4-methoxy-2-methylphenyl)-3-(1-methoxypentan-3-yl)imidazo[4,5-b]pyridine
CID 18001623
2-ethyl-4-[4-methoxy-2-(trifluoromethyl)phenyl]-1-pentan-3-ylimidazo[4,5-c]pyridine
CID 18001537
7-(5-fluoro-4-methoxy-2-methylphenyl)-2-methoxy-3-(1-methoxybutan-2-yl)imidazo[4,5-b]pyridine
CID 18001347
1-(1-cyclopropylpropyl)-4-(2,6-dimethoxy-3-pyridinyl)-2-ethylimidazo[4,5-c]pyridine
CID 18001340
4-(2-chloro-4-methylsulfonylphenyl)-2-ethyl-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001600
4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001464
5-(5-fluoro-4-methoxy-2-methylphenyl)-4,6-dimethylpyrimidine
CID 90142190
5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole
CID 70208467
2-(chloromethyl)-4-methoxy-1-(1-methoxybutan-2-yl)benzimidazole
CID 113393137

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine?
The IUPAC name of 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine (CID 18001485) is 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine.
What is the SMILES notation for 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine?
The canonical SMILES for 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine is CCc1nc2c(-c3cc(F)c(OC)cc3C)nccc2n1C(CC)CC.
What is the InChIKey of 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine?
The InChIKey is GHBGOHSUMMSHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26FN3O/c1-6-14(7-2)25-17-9-10-23-20(21(17)24-19(25)8-3)15-12-16(22)18(26-5)11-13(15)4/h9-12,14H,6-8H2,1-5H3.
What are the key properties of 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine?
2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine has a molecular weight of 355.46 g/mol, XLogP of 5.48, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine is sourced from PubChem (CID 18001485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).