6-cyclohexyl-1-imidazol-1-ylhexan-2-ol

C15H26N2O — CID 21415122

IUPAC6-cyclohexyl-1-imidazol-1-ylhexan-2-ol
SMILESOC(CCCCC1CCCCC1)Cn1ccnc1
InChIInChI=1S/C15H26N2O/c18-15(12-17-11-10-16-13-17)9-5-4-8-14-6-2-1-3-7-14/h10-11,13-15,18H,1-9,12H2
InChIKeyJOZSPKZTZMTEMJ-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.38
Rot. Bonds7

About 6-cyclohexyl-1-imidazol-1-ylhexan-2-ol

6-cyclohexyl-1-imidazol-1-ylhexan-2-ol (PubChem CID 21415122) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 6-cyclohexyl-1-imidazol-1-ylhexan-2-ol.

Molecular Properties

Compound Name6-cyclohexyl-1-imidazol-1-ylhexan-2-ol
PubChem CID21415122
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name6-cyclohexyl-1-imidazol-1-ylhexan-2-ol
SMILESOC(CCCCC1CCCCC1)Cn1ccnc1
InChIInChI=1S/C15H26N2O/c18-15(12-17-11-10-16-13-17)9-5-4-8-14-6-2-1-3-7-14/h10-11,13-15,18H,1-9,12H2
InChIKeyJOZSPKZTZMTEMJ-UHFFFAOYSA-N
XLogP3.38
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-1-imidazol-1-ylhexan-2-ol?
The IUPAC name of 6-cyclohexyl-1-imidazol-1-ylhexan-2-ol (CID 21415122) is 6-cyclohexyl-1-imidazol-1-ylhexan-2-ol.
What is the SMILES notation for 6-cyclohexyl-1-imidazol-1-ylhexan-2-ol?
The canonical SMILES for 6-cyclohexyl-1-imidazol-1-ylhexan-2-ol is OC(CCCCC1CCCCC1)Cn1ccnc1.
What is the InChIKey of 6-cyclohexyl-1-imidazol-1-ylhexan-2-ol?
The InChIKey is JOZSPKZTZMTEMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c18-15(12-17-11-10-16-13-17)9-5-4-8-14-6-2-1-3-7-14/h10-11,13-15,18H,1-9,12H2.
What are the key properties of 6-cyclohexyl-1-imidazol-1-ylhexan-2-ol?
6-cyclohexyl-1-imidazol-1-ylhexan-2-ol has a molecular weight of 250.39 g/mol, XLogP of 3.38, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-1-imidazol-1-ylhexan-2-ol is sourced from PubChem (CID 21415122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).