1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole

C25H24N2O2 — CID 172603383

IUPAC1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole
SMILESCC(c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1)n1ccnc1
InChIInChI=1S/C25H24N2O2/c1-20(27-13-12-26-19-27)23-14-24(28-17-21-8-4-2-5-9-21)16-25(15-23)29-18-22-10-6-3-7-11-22/h2-16,19-20H,17-18H2,1H3
InChIKeyRDEDGFUZCVSCOL-UHFFFAOYSA-N
MW384.48 g/mol
LogP5.65
Rot. Bonds8

About 1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole

1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole (PubChem CID 172603383) has the molecular formula C25H24N2O2 and a molecular weight of 384.48 g/mol. Its IUPAC name is 1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole.

Molecular Properties

Compound Name1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole
PubChem CID172603383
Molecular FormulaC25H24N2O2
Molecular Weight384.48 g/mol
Exact Mass384.18
IUPAC Name1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole
SMILESCC(c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1)n1ccnc1
InChIInChI=1S/C25H24N2O2/c1-20(27-13-12-26-19-27)23-14-24(28-17-21-8-4-2-5-9-21)16-25(15-23)29-18-22-10-6-3-7-11-22/h2-16,19-20H,17-18H2,1H3
InChIKeyRDEDGFUZCVSCOL-UHFFFAOYSA-N
XLogP5.65
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 55.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(3,5-dimethoxyphenyl)ethyl]imidazole
CID 54769240
6-(1-imidazol-1-ylethyl)-1-phenylmethoxybenzotriazole
CID 15097172
1-[1-[4-(phenoxymethyl)phenyl]butyl]imidazole
CID 14514381
3-imidazol-1-yl-1-(4-phenylmethoxyphenyl)-N-propan-2-ylpropan-1-amine
CID 67651862
methanesulfonic acid;1-(1-phenylethyl)imidazole
CID 174969600
1,3-bis[[3,5-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]phenyl]methoxy]-5-methylbenzene
CID 102395902
3-pentan-2-yl-5-phenylmethoxypyridine
CID 166644961
(1R)-1-imidazol-1-yl-2-phenylethanol
CID 91356696
1,3-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-5-(2-methylpropyl)benzene
CID 59422757
1-bromo-3-phenylmethoxy-5-propan-2-ylbenzene
CID 162421142
1-(4-methyl-1-phenylpentan-3-yl)imidazole
CID 69408176
3-[[6-[2-(dimethylamino)-1-imidazol-1-ylpropyl]naphthalen-2-yl]oxymethyl]benzoic acid
CID 11235737

Frequently Asked Questions

What is the IUPAC name of 1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole?
The IUPAC name of 1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole (CID 172603383) is 1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole.
What is the SMILES notation for 1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole?
The canonical SMILES for 1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole is CC(c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1)n1ccnc1.
What is the InChIKey of 1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole?
The InChIKey is RDEDGFUZCVSCOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O2/c1-20(27-13-12-26-19-27)23-14-24(28-17-21-8-4-2-5-9-21)16-25(15-23)29-18-22-10-6-3-7-11-22/h2-16,19-20H,17-18H2,1H3.
What are the key properties of 1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole?
1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole has a molecular weight of 384.48 g/mol, XLogP of 5.65, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[3,5-bis(phenylmethoxy)phenyl]ethyl]imidazole is sourced from PubChem (CID 172603383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).