4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine

C19H21Cl2N3O2 — CID 18001464

IUPAC4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
SMILESCCC(CCOC)n1c(OC)nc2c(-c3ccc(Cl)cc3Cl)nccc21
InChIInChI=1S/C19H21Cl2N3O2/c1-4-13(8-10-25-2)24-16-7-9-22-17(18(16)23-19(24)26-3)14-6-5-12(20)11-15(14)21/h5-7,9,11,13H,4,8,10H2,1-3H3
InChIKeyWNGYNMXGVFGZQB-UHFFFAOYSA-N
MW394.30 g/mol
LogP5.40
Rot. Bonds7

About 4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine

4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine (PubChem CID 18001464) has the molecular formula C19H21Cl2N3O2 and a molecular weight of 394.30 g/mol. Its IUPAC name is 4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
PubChem CID18001464
Molecular FormulaC19H21Cl2N3O2
Molecular Weight394.30 g/mol
Exact Mass393.10
IUPAC Name4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
SMILESCCC(CCOC)n1c(OC)nc2c(-c3ccc(Cl)cc3Cl)nccc21
InChIInChI=1S/C19H21Cl2N3O2/c1-4-13(8-10-25-2)24-16-7-9-22-17(18(16)23-19(24)26-3)14-6-5-12(20)11-15(14)21/h5-7,9,11,13H,4,8,10H2,1-3H3
InChIKeyWNGYNMXGVFGZQB-UHFFFAOYSA-N
XLogP5.40
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.30
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2,6-dimethyl-3-pyridinyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001474
5-(2,4-dichlorophenyl)-1-[(2R)-1-methoxybutan-2-yl]-3-methylpyrido[3,4-b]pyrazin-2-one
CID 10385822
4-(2-chloro-4-methylsulfonylphenyl)-2-ethyl-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001600
4-(2-chloro-5-fluoro-4-methylphenyl)-2-ethyl-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001639
4-(5-fluoro-4-methoxy-2-methylphenyl)-2-methoxy-1-(1-methoxybutan-2-yl)imidazo[4,5-c]pyridine
CID 18001490
4-(5-fluoro-4-methoxy-2-methylphenyl)-2-methoxy-1-pentan-3-ylimidazo[4,5-c]pyridine
CID 18001531
2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001399
2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 141006902
1-[(1R)-1-cyclopropylpropyl]-5-(2,4-dichlorophenyl)-3-methylpyrido[3,4-b]pyrazin-2-one
CID 10385581
2-methoxy-3-(1-methoxybutan-2-yl)-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine
CID 18001588
2-ethyl-7-(5-fluoro-4-methoxy-2-methylphenyl)-3-(1-methoxypentan-3-yl)imidazo[4,5-b]pyridine
CID 18001623
2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine
CID 18001485

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine?
The IUPAC name of 4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine (CID 18001464) is 4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine.
What is the SMILES notation for 4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine?
The canonical SMILES for 4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine is CCC(CCOC)n1c(OC)nc2c(-c3ccc(Cl)cc3Cl)nccc21.
What is the InChIKey of 4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine?
The InChIKey is WNGYNMXGVFGZQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21Cl2N3O2/c1-4-13(8-10-25-2)24-16-7-9-22-17(18(16)23-19(24)26-3)14-6-5-12(20)11-15(14)21/h5-7,9,11,13H,4,8,10H2,1-3H3.
What are the key properties of 4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine?
4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine has a molecular weight of 394.30 g/mol, XLogP of 5.40, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine is sourced from PubChem (CID 18001464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).