1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole

C10H16N2 — CID 89346878

IUPAC1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole
SMILESCC1CC=C(N2C=NCC2)CC1
InChIInChI=1S/C10H16N2/c1-9-2-4-10(5-3-9)12-7-6-11-8-12/h4,8-9H,2-3,5-7H2,1H3
InChIKeyITHCQEWXCHRZQF-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.03
Rot. Bonds1

About 1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole

1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole (PubChem CID 89346878) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole.

Molecular Properties

Compound Name1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole
PubChem CID89346878
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole
SMILESCC1CC=C(N2C=NCC2)CC1
InChIInChI=1S/C10H16N2/c1-9-2-4-10(5-3-9)12-7-6-11-8-12/h4,8-9H,2-3,5-7H2,1H3
InChIKeyITHCQEWXCHRZQF-UHFFFAOYSA-N
XLogP2.03
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole?
The IUPAC name of 1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole (CID 89346878) is 1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole.
What is the SMILES notation for 1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole?
The canonical SMILES for 1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole is CC1CC=C(N2C=NCC2)CC1.
What is the InChIKey of 1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole?
The InChIKey is ITHCQEWXCHRZQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-9-2-4-10(5-3-9)12-7-6-11-8-12/h4,8-9H,2-3,5-7H2,1H3.
What are the key properties of 1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole?
1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole has a molecular weight of 164.25 g/mol, XLogP of 2.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylcyclohexen-1-yl)-4,5-dihydroimidazole is sourced from PubChem (CID 89346878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).