3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol

C14H25NO — CID 106651371

IUPAC3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol
SMILESNC1CCCC(O)(C2=CCCCCCC2)C1
InChIInChI=1S/C14H25NO/c15-13-9-6-10-14(16,11-13)12-7-4-2-1-3-5-8-12/h7,13,16H,1-6,8-11,15H2
InChIKeyCUDCVTHEERPMCD-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.90
Rot. Bonds1

About 3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol

3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol (PubChem CID 106651371) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol
PubChem CID106651371
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol
SMILESNC1CCCC(O)(C2=CCCCCCC2)C1
InChIInChI=1S/C14H25NO/c15-13-9-6-10-14(16,11-13)12-7-4-2-1-3-5-8-12/h7,13,16H,1-6,8-11,15H2
InChIKeyCUDCVTHEERPMCD-UHFFFAOYSA-N
XLogP2.90
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-amino-1-(cyclohexen-1-yl)cyclohexan-1-ol
CID 106651372
1-(cyclohepten-1-yl)-3-(2-methylpropyl)cyclohexan-1-ol
CID 107429787
1-(cyclohepten-1-yl)-4-propylcycloheptan-1-ol
CID 106651210
4-(cycloocten-1-yl)-4-hydroxycyclohexan-1-one
CID 106651235
1-(cyclohexen-1-yl)-4,4-dimethylcyclohexan-1-ol
CID 106651138
1-(cyclohepten-1-yl)-3,5-dimethylcyclohexan-1-ol
CID 106651160
3-(cycloocten-1-yl)piperidin-3-ol
CID 106650906
3-amino-1-phenylcyclohexan-1-ol
CID 80562038
4-(cycloocten-1-yl)-2-propyloxan-4-ol
CID 106651119
3-(cyclohepten-1-yl)-1-methylpyrrolidin-3-ol
CID 106650886
3-amino-1-(3,5-difluorophenyl)cyclohexan-1-ol
CID 80562436
1-(cycloocten-1-yl)-2-methylcyclohexan-1-ol
CID 106650767

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol?
The IUPAC name of 3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol (CID 106651371) is 3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol.
What is the SMILES notation for 3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol?
The canonical SMILES for 3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol is NC1CCCC(O)(C2=CCCCCCC2)C1.
What is the InChIKey of 3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol?
The InChIKey is CUDCVTHEERPMCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c15-13-9-6-10-14(16,11-13)12-7-4-2-1-3-5-8-12/h7,13,16H,1-6,8-11,15H2.
What are the key properties of 3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol?
3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol has a molecular weight of 223.36 g/mol, XLogP of 2.90, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(cycloocten-1-yl)cyclohexan-1-ol is sourced from PubChem (CID 106651371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).