cyclohepten-1-yl(cyclopentyl)methanol

C13H22O — CID 62078752

IUPACcyclohepten-1-yl(cyclopentyl)methanol
SMILESOC(C1=CCCCCC1)C1CCCC1
InChIInChI=1S/C13H22O/c14-13(12-9-5-6-10-12)11-7-3-1-2-4-8-11/h7,12-14H,1-6,8-10H2
InChIKeyZAXJHVSYILWPQF-UHFFFAOYSA-N
MW194.32 g/mol
LogP3.43
Rot. Bonds2

About cyclohepten-1-yl(cyclopentyl)methanol

cyclohepten-1-yl(cyclopentyl)methanol (PubChem CID 62078752) has the molecular formula C13H22O and a molecular weight of 194.32 g/mol. Its IUPAC name is cyclohepten-1-yl(cyclopentyl)methanol.

Molecular Properties

Compound Namecyclohepten-1-yl(cyclopentyl)methanol
PubChem CID62078752
Molecular FormulaC13H22O
Molecular Weight194.32 g/mol
Exact Mass194.17
IUPAC Namecyclohepten-1-yl(cyclopentyl)methanol
SMILESOC(C1=CCCCCC1)C1CCCC1
InChIInChI=1S/C13H22O/c14-13(12-9-5-6-10-12)11-7-3-1-2-4-8-11/h7,12-14H,1-6,8-10H2
InChIKeyZAXJHVSYILWPQF-UHFFFAOYSA-N
XLogP3.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze cyclohepten-1-yl(cyclopentyl)methanol 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

cycloocten-1-yl(cyclopropyl)methanol
CID 106651053
1-(cycloocten-1-yl)-2-cyclopropylethanol
CID 106657572
6-bicyclo[3.1.0]hexanyl(cycloocten-1-yl)methanol
CID 106657681
cyclohepten-1-yl(cyclooctyl)methanamine
CID 65018804
cyclohepten-1-yl(cyclopentyl)methanamine
CID 62079813
2-cyclobutyl-1-(cyclohepten-1-yl)ethanol
CID 103165442
2-cyclobutyl-1-(cycloocten-1-yl)ethanol
CID 106657591
cyclohepten-1-yl-(2-methylcyclopentyl)methanol
CID 107181713
cyclohepten-1-yl-(2-methylcyclopropyl)methanol
CID 62078578
cyclohepten-1-yl-(5-methyloxolan-3-yl)methanol
CID 114826734
cyclohepten-1-yl(oxolan-2-yl)methanol
CID 62078402
cycloocten-1-yl-(2,2-dimethylcyclopropyl)methanol
CID 107005521

Frequently Asked Questions

What is the IUPAC name of cyclohepten-1-yl(cyclopentyl)methanol?
The IUPAC name of cyclohepten-1-yl(cyclopentyl)methanol (CID 62078752) is cyclohepten-1-yl(cyclopentyl)methanol.
What is the SMILES notation for cyclohepten-1-yl(cyclopentyl)methanol?
The canonical SMILES for cyclohepten-1-yl(cyclopentyl)methanol is OC(C1=CCCCCC1)C1CCCC1.
What is the InChIKey of cyclohepten-1-yl(cyclopentyl)methanol?
The InChIKey is ZAXJHVSYILWPQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O/c14-13(12-9-5-6-10-12)11-7-3-1-2-4-8-11/h7,12-14H,1-6,8-10H2.
What are the key properties of cyclohepten-1-yl(cyclopentyl)methanol?
cyclohepten-1-yl(cyclopentyl)methanol has a molecular weight of 194.32 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohepten-1-yl(cyclopentyl)methanol is sourced from PubChem (CID 62078752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).