2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol

C14H20N4O — CID 44591431

IUPAC2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol
SMILESOC1C(Cn2ccnc2)CCCC1Cn1ccnc1
InChIInChI=1S/C14H20N4O/c19-14-12(8-17-6-4-15-10-17)2-1-3-13(14)9-18-7-5-16-11-18/h4-7,10-14,19H,1-3,8-9H2
InChIKeyDUSXOHUZOLFDSP-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.56
Rot. Bonds4

About 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol

2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol (PubChem CID 44591431) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol
PubChem CID44591431
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol
SMILESOC1C(Cn2ccnc2)CCCC1Cn1ccnc1
InChIInChI=1S/C14H20N4O/c19-14-12(8-17-6-4-15-10-17)2-1-3-13(14)9-18-7-5-16-11-18/h4-7,10-14,19H,1-3,8-9H2
InChIKeyDUSXOHUZOLFDSP-UHFFFAOYSA-N
XLogP1.56
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5',7'-Dihydrospiro[cyclohexane-1,6'-pyrrolo-[1,2-a]imidazol]-3-yl)methanol
CID 134691343
2-(1-Ethylimidazol-2-yl)-1-[3-(trifluoromethyl)cyclohexyl]ethanol
CID 105112302
2-(1-Methylimidazol-2-yl)-1-[3-(trifluoromethyl)cyclohexyl]ethanol
CID 105113545
2-(1-Propylimidazol-2-yl)-1-[3-(trifluoromethyl)cyclohexyl]ethanol
CID 105114015
3-(1-Methylimidazol-2-yl)-1-[3-(trifluoromethyl)cyclohexyl]propan-1-ol
CID 105130876
2-[[[1-(Difluoromethyl)imidazol-2-yl]methyl-methylamino]methyl]cyclohexan-1-ol
CID 109999364
2-[[Methyl-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]amino]methyl]cyclohexan-1-ol
CID 109999402
2-[1-[[1-(Difluoromethyl)imidazol-2-yl]methyl]pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339717
Cyclohexyl-[1-[[1-(difluoromethyl)imidazol-2-yl]methyl]imidazol-2-yl]methanol
CID 145879813
1-[3-(Cyclohexylmethyl)-3-hydroxy-n-heptyl]imidazole
CID 20279069
2-Imidazol-1-yl-1-(4-methylcyclohexyl)ethanol
CID 20282134
1-Cyclohexyl-2-imidazol-1-ylethanol
CID 20282494

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol?
The IUPAC name of 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol (CID 44591431) is 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol.
What is the SMILES notation for 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol?
The canonical SMILES for 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol is OC1C(Cn2ccnc2)CCCC1Cn1ccnc1.
What is the InChIKey of 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol?
The InChIKey is DUSXOHUZOLFDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c19-14-12(8-17-6-4-15-10-17)2-1-3-13(14)9-18-7-5-16-11-18/h4-7,10-14,19H,1-3,8-9H2.
What are the key properties of 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol?
2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol has a molecular weight of 260.34 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(imidazol-1-ylmethyl)cyclohexan-1-ol is sourced from PubChem (CID 44591431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).