1-(phenylmethoxymethyl)imidazole

C11H12N2O — CID 14795908

IUPAC1-(phenylmethoxymethyl)imidazole
SMILESc1ccc(COCn2ccnc2)cc1
InChIInChI=1S/C11H12N2O/c1-2-4-11(5-3-1)8-14-10-13-7-6-12-9-13/h1-7,9H,8,10H2
InChIKeyHPMFKOBTJATLDZ-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.06
Rot. Bonds4

About 1-(phenylmethoxymethyl)imidazole

1-(phenylmethoxymethyl)imidazole (PubChem CID 14795908) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 1-(phenylmethoxymethyl)imidazole.

Molecular Properties

Compound Name1-(phenylmethoxymethyl)imidazole
PubChem CID14795908
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name1-(phenylmethoxymethyl)imidazole
SMILESc1ccc(COCn2ccnc2)cc1
InChIInChI=1S/C11H12N2O/c1-2-4-11(5-3-1)8-14-10-13-7-6-12-9-13/h1-7,9H,8,10H2
InChIKeyHPMFKOBTJATLDZ-UHFFFAOYSA-N
XLogP2.06
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(phenethyloxy)-1H-imidazole
CID 1491082
2-(1H-imidazol-1-yl)-1-phenylethanol
CID 32239
1-[(4-bromobenzyl)oxy]-1H-imidazole
CID 1491058
1-(2-(Benzyloxy)ethyl)imidazole
CID 4146595
1-(3-benzyloxy-1(E)octenyl)imidazole
CID 6436121
1H-Imidazolium, 2-((hydroxyimino)methyl)-1-methyl-3-((3-phenylpropoxy)methyl)-, chloride
CID 135705517
1-[(3,5-dimethylbenzyl)oxy]-1H-imidazole
CID 1491089
N,N-dimethyl-1-(1-methylimidazol-2-yl)oxy-7-phenylheptan-3-amine
CID 122189563
1-[[4-(1,1-Dimethylethyl)phenyl]methoxy]-1H-imidazole
CID 1491084
1H-Imidazolium, 1-((((cyclopentylphenyl)methyl)oxy)methyl)-2-((hydroxyimino)methyl)-3-methyl-, chloride
CID 135705429
1H-Imidazolium, 2-((hydroxyimino)methyl)-3-methyl-1-(((1-phenylbutyl)oxy)methyl)-, chloride
CID 135705507
1H-Imidazolium, 2-((hydroxyimino)methyl)-3-methyl-1-(((phenylmethyl)oxy)methyl)-, chloride
CID 135705511

Frequently Asked Questions

What is the IUPAC name of 1-(phenylmethoxymethyl)imidazole?
The IUPAC name of 1-(phenylmethoxymethyl)imidazole (CID 14795908) is 1-(phenylmethoxymethyl)imidazole.
What is the SMILES notation for 1-(phenylmethoxymethyl)imidazole?
The canonical SMILES for 1-(phenylmethoxymethyl)imidazole is c1ccc(COCn2ccnc2)cc1.
What is the InChIKey of 1-(phenylmethoxymethyl)imidazole?
The InChIKey is HPMFKOBTJATLDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-2-4-11(5-3-1)8-14-10-13-7-6-12-9-13/h1-7,9H,8,10H2.
What are the key properties of 1-(phenylmethoxymethyl)imidazole?
1-(phenylmethoxymethyl)imidazole has a molecular weight of 188.23 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(phenylmethoxymethyl)imidazole is sourced from PubChem (CID 14795908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).