2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole

C11H14N2O — CID 45487958

IUPAC2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole
SMILESCc1ccccc1COC1=NCCN1
InChIInChI=1S/C11H14N2O/c1-9-4-2-3-5-10(9)8-14-11-12-6-7-13-11/h2-5H,6-8H2,1H3,(H,12,13)
InChIKeyLGTDYALRCIBCMI-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.47
Rot. Bonds2

About 2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole

2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole (PubChem CID 45487958) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole
PubChem CID45487958
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole
SMILESCc1ccccc1COC1=NCCN1
InChIInChI=1S/C11H14N2O/c1-9-4-2-3-5-10(9)8-14-11-12-6-7-13-11/h2-5H,6-8H2,1H3,(H,12,13)
InChIKeyLGTDYALRCIBCMI-UHFFFAOYSA-N
XLogP1.47
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole (CID 45487958) is 2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole is Cc1ccccc1COC1=NCCN1.
What is the InChIKey of 2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole?
The InChIKey is LGTDYALRCIBCMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-9-4-2-3-5-10(9)8-14-11-12-6-7-13-11/h2-5H,6-8H2,1H3,(H,12,13).
What are the key properties of 2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole?
2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole has a molecular weight of 190.25 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylphenyl)methoxy]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 45487958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).