cycloocten-1-yl(piperidin-2-yl)methanol

C14H25NO — CID 106651718

IUPACcycloocten-1-yl(piperidin-2-yl)methanol
SMILESOC(C1=CCCCCCC1)C1CCCCN1
InChIInChI=1S/C14H25NO/c16-14(13-10-6-7-11-15-13)12-8-4-2-1-3-5-9-12/h8,13-16H,1-7,9-11H2
InChIKeyVMWMIGWSXIPHKJ-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.77
Rot. Bonds2

About cycloocten-1-yl(piperidin-2-yl)methanol

cycloocten-1-yl(piperidin-2-yl)methanol (PubChem CID 106651718) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is cycloocten-1-yl(piperidin-2-yl)methanol.

Molecular Properties

Compound Namecycloocten-1-yl(piperidin-2-yl)methanol
PubChem CID106651718
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Namecycloocten-1-yl(piperidin-2-yl)methanol
SMILESOC(C1=CCCCCCC1)C1CCCCN1
InChIInChI=1S/C14H25NO/c16-14(13-10-6-7-11-15-13)12-8-4-2-1-3-5-9-12/h8,13-16H,1-7,9-11H2
InChIKeyVMWMIGWSXIPHKJ-UHFFFAOYSA-N
XLogP2.77
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cycloocten-1-yl(piperidin-2-yl)methanol?
The IUPAC name of cycloocten-1-yl(piperidin-2-yl)methanol (CID 106651718) is cycloocten-1-yl(piperidin-2-yl)methanol.
What is the SMILES notation for cycloocten-1-yl(piperidin-2-yl)methanol?
The canonical SMILES for cycloocten-1-yl(piperidin-2-yl)methanol is OC(C1=CCCCCCC1)C1CCCCN1.
What is the InChIKey of cycloocten-1-yl(piperidin-2-yl)methanol?
The InChIKey is VMWMIGWSXIPHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c16-14(13-10-6-7-11-15-13)12-8-4-2-1-3-5-9-12/h8,13-16H,1-7,9-11H2.
What are the key properties of cycloocten-1-yl(piperidin-2-yl)methanol?
cycloocten-1-yl(piperidin-2-yl)methanol has a molecular weight of 223.36 g/mol, XLogP of 2.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cycloocten-1-yl(piperidin-2-yl)methanol is sourced from PubChem (CID 106651718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).