2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine

C18H18ClN3O3 — CID 175183178

IUPAC2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine
SMILESCCOc1cccc(-c2nc(Cl)cn2-c2c(OC)cccc2OC)n1
InChIInChI=1S/C18H18ClN3O3/c1-4-25-16-10-5-7-12(20-16)18-21-15(19)11-22(18)17-13(23-2)8-6-9-14(17)24-3/h5-11H,4H2,1-3H3
InChIKeyQTUQFYNSTPLMEL-UHFFFAOYSA-N
MW359.81 g/mol
LogP4.00
Rot. Bonds6

About 2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine

2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine (PubChem CID 175183178) has the molecular formula C18H18ClN3O3 and a molecular weight of 359.81 g/mol. Its IUPAC name is 2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine.

Molecular Properties

Compound Name2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine
PubChem CID175183178
Molecular FormulaC18H18ClN3O3
Molecular Weight359.81 g/mol
Exact Mass359.10
IUPAC Name2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine
SMILESCCOc1cccc(-c2nc(Cl)cn2-c2c(OC)cccc2OC)n1
InChIInChI=1S/C18H18ClN3O3/c1-4-25-16-10-5-7-12(20-16)18-21-15(19)11-22(18)17-13(23-2)8-6-9-14(17)24-3/h5-11H,4H2,1-3H3
InChIKeyQTUQFYNSTPLMEL-UHFFFAOYSA-N
XLogP4.00
TPSA58.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.81
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine?
The IUPAC name of 2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine (CID 175183178) is 2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine.
What is the SMILES notation for 2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine?
The canonical SMILES for 2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine is CCOc1cccc(-c2nc(Cl)cn2-c2c(OC)cccc2OC)n1.
What is the InChIKey of 2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine?
The InChIKey is QTUQFYNSTPLMEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O3/c1-4-25-16-10-5-7-12(20-16)18-21-15(19)11-22(18)17-13(23-2)8-6-9-14(17)24-3/h5-11H,4H2,1-3H3.
What are the key properties of 2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine?
2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine has a molecular weight of 359.81 g/mol, XLogP of 4.00, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-chloro-1-(2,6-dimethoxyphenyl)imidazol-2-yl]-6-ethoxypyridine is sourced from PubChem (CID 175183178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).