5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole

C20H22N2O2 — CID 15749941

IUPAC5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole
SMILESCOc1ccc(COc2cccc(-c3cncn3C(C)C)c2)cc1
InChIInChI=1S/C20H22N2O2/c1-15(2)22-14-21-12-20(22)17-5-4-6-19(11-17)24-13-16-7-9-18(23-3)10-8-16/h4-12,14-15H,13H2,1-3H3
InChIKeyGHZSSKVYXCXZBJ-UHFFFAOYSA-N
MW322.41 g/mol
LogP4.72
Rot. Bonds6

About 5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole

5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole (PubChem CID 15749941) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole.

Molecular Properties

Compound Name5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole
PubChem CID15749941
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole
SMILESCOc1ccc(COc2cccc(-c3cncn3C(C)C)c2)cc1
InChIInChI=1S/C20H22N2O2/c1-15(2)22-14-21-12-20(22)17-5-4-6-19(11-17)24-13-16-7-9-18(23-3)10-8-16/h4-12,14-15H,13H2,1-3H3
InChIKeyGHZSSKVYXCXZBJ-UHFFFAOYSA-N
XLogP4.72
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[3-[(4-fluorophenyl)methoxy]phenyl]-1-propan-2-ylimidazole
CID 15749942
1-[3-[(4-methoxyphenyl)methoxy]phenyl]ethanamine
CID 60879205
1-fluoro-4-[(3-methoxyphenoxy)methyl]benzene
CID 59165653
5-[(6-bromonaphthalen-2-yl)oxymethyl]-1-propan-2-ylimidazole
CID 66154990
1-[2-[3-[(4-methoxyphenyl)methoxy]phenyl]-5H-pyrrolo[2,3-b]pyrazin-7-yl]-2-methylprop-2-en-1-one
CID 89148689
3-[(4-methoxyphenyl)methoxy]benzaldehyde
CID 14972990
5-[(4-methoxyphenyl)methoxy]-2-pyridin-3-yl-1,3-benzoxazole
CID 118905169
5-[3-[(4-methoxyphenyl)methoxy]phenyl]-2-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 59589851
2-[(3-methoxyphenoxy)methyl]-1-propan-2-ylimidazol-4-amine
CID 117187706
4-[(4-methoxyphenyl)methoxy]pyridine
CID 54365889
1-(2-methylpropyl)-5-(3-prop-2-enoxyphenyl)imidazole
CID 67055620
1-[3-[(3,5-dimethoxyphenyl)methoxy]phenyl]-5-methylimidazole
CID 141209549

Frequently Asked Questions

What is the IUPAC name of 5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole?
The IUPAC name of 5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole (CID 15749941) is 5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole.
What is the SMILES notation for 5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole?
The canonical SMILES for 5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole is COc1ccc(COc2cccc(-c3cncn3C(C)C)c2)cc1.
What is the InChIKey of 5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole?
The InChIKey is GHZSSKVYXCXZBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-15(2)22-14-21-12-20(22)17-5-4-6-19(11-17)24-13-16-7-9-18(23-3)10-8-16/h4-12,14-15H,13H2,1-3H3.
What are the key properties of 5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole?
5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole has a molecular weight of 322.41 g/mol, XLogP of 4.72, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[(4-methoxyphenyl)methoxy]phenyl]-1-propan-2-ylimidazole is sourced from PubChem (CID 15749941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).