cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol

C14H24O — CID 107181706

IUPACcyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol
SMILESCC1(C)CCCC1C(O)C1=CCCCC1
InChIInChI=1S/C14H24O/c1-14(2)10-6-9-12(14)13(15)11-7-4-3-5-8-11/h7,12-13,15H,3-6,8-10H2,1-2H3
InChIKeyHTXUCWMOUDMTCR-UHFFFAOYSA-N
MW208.34 g/mol
LogP3.67
Rot. Bonds2

About cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol

cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol (PubChem CID 107181706) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol.

Molecular Properties

Compound Namecyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol
PubChem CID107181706
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Namecyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol
SMILESCC1(C)CCCC1C(O)C1=CCCCC1
InChIInChI=1S/C14H24O/c1-14(2)10-6-9-12(14)13(15)11-7-4-3-5-8-11/h7,12-13,15H,3-6,8-10H2,1-2H3
InChIKeyHTXUCWMOUDMTCR-UHFFFAOYSA-N
XLogP3.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

cycloocten-1-yl-(2,2-dimethylcyclopropyl)methanol
CID 107005521
cycloocten-1-yl(cyclopropyl)methanol
CID 106651053
cyclohepten-1-yl(cyclopentyl)methanol
CID 62078752
cyclohepten-1-yl-(2-methylcyclopentyl)methanol
CID 107181713
(3-bromo-2-fluorophenyl)-(2,2-dimethylcyclopentyl)methanol
CID 107193133
cyclohepten-1-yl-(2-methylcyclopropyl)methanol
CID 62078578
6-bicyclo[3.1.0]hexanyl(cycloocten-1-yl)methanol
CID 106657681
(3,5-difluorophenyl)-(2,2-dimethylcyclopentyl)methanol
CID 107192212
1-(2,2-dimethylcyclopentyl)ethanol
CID 79863633
(2R)-1-(2,2-dimethylcyclopentyl)-2,3-dimethylbutan-1-ol
CID 143524779
cyclohexen-1-ylmethanediol
CID 21392290
(2,2-dimethylcyclopentyl)-(4-fluoronaphthalen-1-yl)methanol
CID 107181750

Frequently Asked Questions

What is the IUPAC name of cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol?
The IUPAC name of cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol (CID 107181706) is cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol.
What is the SMILES notation for cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol?
The canonical SMILES for cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol is CC1(C)CCCC1C(O)C1=CCCCC1.
What is the InChIKey of cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol?
The InChIKey is HTXUCWMOUDMTCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-14(2)10-6-9-12(14)13(15)11-7-4-3-5-8-11/h7,12-13,15H,3-6,8-10H2,1-2H3.
What are the key properties of cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol?
cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol has a molecular weight of 208.34 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-yl-(2,2-dimethylcyclopentyl)methanol is sourced from PubChem (CID 107181706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).