2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole

C19H19ClN2O2 — CID 10569356

IUPAC2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole
SMILESCOc1cccc(C(OCc2ccc(Cl)cc2)c2nccn2C)c1
InChIInChI=1S/C19H19ClN2O2/c1-22-11-10-21-19(22)18(15-4-3-5-17(12-15)23-2)24-13-14-6-8-16(20)9-7-14/h3-12,18H,13H2,1-2H3
InChIKeyUUKDPEQFGZWRFN-UHFFFAOYSA-N
MW342.83 g/mol
LogP4.39
Rot. Bonds6

About 2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole

2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole (PubChem CID 10569356) has the molecular formula C19H19ClN2O2 and a molecular weight of 342.83 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole.

Molecular Properties

Compound Name2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole
PubChem CID10569356
Molecular FormulaC19H19ClN2O2
Molecular Weight342.83 g/mol
Exact Mass342.11
IUPAC Name2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole
SMILESCOc1cccc(C(OCc2ccc(Cl)cc2)c2nccn2C)c1
InChIInChI=1S/C19H19ClN2O2/c1-22-11-10-21-19(22)18(15-4-3-5-17(12-15)23-2)24-13-14-6-8-16(20)9-7-14/h3-12,18H,13H2,1-2H3
InChIKeyUUKDPEQFGZWRFN-UHFFFAOYSA-N
XLogP4.39
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.83
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(S)-(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-2-(3-methoxyphenyl)acetamide
CID 25351466
1-chloro-4-[[2-iodo-1-(3-methoxyphenyl)ethoxy]methyl]benzene
CID 114774472
2,4-dichloro-N-[(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]benzamide
CID 51269170
3-(3-methoxyphenyl)-3-(1-methylimidazol-2-yl)propanoic acid
CID 82484426
1-[2-(4-chlorophenoxy)ethyl]-3-[(R)-(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]urea
CID 36506060
2-(4-chlorophenyl)-N-[(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]acetamide
CID 18103829
2,5-dichloro-N-[(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]benzenesulfonamide
CID 24541230
1-[2-(3-chlorophenyl)ethyl]-3-[(S)-(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]urea
CID 36524692
N-[(S)-(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-2-phenylacetamide
CID 40720270
2-(2-chloro-6-fluorophenyl)-N-[(S)-(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]acetamide
CID 40797865
N-[(R)-(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-2-(4-phenylphenyl)acetamide
CID 25350189
3-(4-methoxyphenyl)-N-[(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]propanamide
CID 51269269

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole?
The IUPAC name of 2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole (CID 10569356) is 2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole.
What is the SMILES notation for 2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole?
The canonical SMILES for 2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole is COc1cccc(C(OCc2ccc(Cl)cc2)c2nccn2C)c1.
What is the InChIKey of 2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole?
The InChIKey is UUKDPEQFGZWRFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O2/c1-22-11-10-21-19(22)18(15-4-3-5-17(12-15)23-2)24-13-14-6-8-16(20)9-7-14/h3-12,18H,13H2,1-2H3.
What are the key properties of 2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole?
2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole has a molecular weight of 342.83 g/mol, XLogP of 4.39, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)methoxy-(3-methoxyphenyl)methyl]-1-methylimidazole is sourced from PubChem (CID 10569356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).