1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride

C15H27ClN2 — CID 173048442

IUPAC1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride
SMILESC1CCC(C2=NCCN2C2CCCCC2)CC1.Cl
InChIInChI=1S/C15H26N2.ClH/c1-3-7-13(8-4-1)15-16-11-12-17(15)14-9-5-2-6-10-14;/h13-14H,1-12H2;1H
InChIKeyUUIJUXMJLPKADV-UHFFFAOYSA-N
MW270.85 g/mol
LogP4.04
Rot. Bonds2

About 1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride

1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride (PubChem CID 173048442) has the molecular formula C15H27ClN2 and a molecular weight of 270.85 g/mol. Its IUPAC name is 1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride.

Molecular Properties

Compound Name1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride
PubChem CID173048442
Molecular FormulaC15H27ClN2
Molecular Weight270.85 g/mol
Exact Mass270.19
IUPAC Name1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride
SMILESC1CCC(C2=NCCN2C2CCCCC2)CC1.Cl
InChIInChI=1S/C15H26N2.ClH/c1-3-7-13(8-4-1)15-16-11-12-17(15)14-9-5-2-6-10-14;/h13-14H,1-12H2;1H
InChIKeyUUIJUXMJLPKADV-UHFFFAOYSA-N
XLogP4.04
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.85
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride?
The IUPAC name of 1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride (CID 173048442) is 1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride.
What is the SMILES notation for 1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride?
The canonical SMILES for 1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride is C1CCC(C2=NCCN2C2CCCCC2)CC1.Cl.
What is the InChIKey of 1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride?
The InChIKey is UUIJUXMJLPKADV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2.ClH/c1-3-7-13(8-4-1)15-16-11-12-17(15)14-9-5-2-6-10-14;/h13-14H,1-12H2;1H.
What are the key properties of 1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride?
1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride has a molecular weight of 270.85 g/mol, XLogP of 4.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dicyclohexyl-4,5-dihydroimidazole;hydrochloride is sourced from PubChem (CID 173048442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).