1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole

C14H16N2 — CID 67927146

IUPAC1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole
SMILESCc1ccccc1Cc1nccn1C1CC1
InChIInChI=1S/C14H16N2/c1-11-4-2-3-5-12(11)10-14-15-8-9-16(14)13-6-7-13/h2-5,8-9,13H,6-7,10H2,1H3
InChIKeyTWQGNXOAVZUXPP-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.12
Rot. Bonds3

About 1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole

1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole (PubChem CID 67927146) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole.

Molecular Properties

Compound Name1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole
PubChem CID67927146
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole
SMILESCc1ccccc1Cc1nccn1C1CC1
InChIInChI=1S/C14H16N2/c1-11-4-2-3-5-12(11)10-14-15-8-9-16(14)13-6-7-13/h2-5,8-9,13H,6-7,10H2,1H3
InChIKeyTWQGNXOAVZUXPP-UHFFFAOYSA-N
XLogP3.12
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(1-cyclopentylimidazol-2-yl)methyl]aniline
CID 82558770
1-cyclopropyl-2-(2,2-dimethylpropyl)imidazole
CID 138748973
N-[(1-cyclopropylimidazol-2-yl)methyl]-1-phenylmethanamine
CID 165476027
4-[2-[(2,4-difluorophenyl)methyl]imidazol-1-yl]piperidine
CID 82558361
2-ethyl-1-(4-methylcyclohexyl)imidazole
CID 64776318
N-[(1-cyclopropylimidazol-2-yl)methyl]-N-methyl-2-phenylsulfanylethanamine
CID 91841929
1-[(1-methylimidazol-2-yl)methyl]-4-[2-(2-methylphenyl)ethyl]piperazine
CID 46984988
1-cyclopropyl-N-(2,6-diethylphenyl)imidazol-2-amine
CID 106556079
2-[2-[4-[(1-cyclopropylimidazol-2-yl)methyl]piperazin-1-yl]ethyl]pyridazin-3-one
CID 126913460
1-cyclopropyl-N-[2-(methoxymethyl)phenyl]imidazol-2-amine
CID 106568622
3-[(2-methylphenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol
CID 117148877
1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine
CID 106559126

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole?
The IUPAC name of 1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole (CID 67927146) is 1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole.
What is the SMILES notation for 1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole?
The canonical SMILES for 1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole is Cc1ccccc1Cc1nccn1C1CC1.
What is the InChIKey of 1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole?
The InChIKey is TWQGNXOAVZUXPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-11-4-2-3-5-12(11)10-14-15-8-9-16(14)13-6-7-13/h2-5,8-9,13H,6-7,10H2,1H3.
What are the key properties of 1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole?
1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole has a molecular weight of 212.30 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[(2-methylphenyl)methyl]imidazole is sourced from PubChem (CID 67927146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).