4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol

C13H23NO — CID 106650847

IUPAC4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol
SMILESCN1CCC(O)(C2=CCCCCC2)CC1
InChIInChI=1S/C13H23NO/c1-14-10-8-13(15,9-11-14)12-6-4-2-3-5-7-12/h6,15H,2-5,7-11H2,1H3
InChIKeyAQINZABVQROIKL-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.33
Rot. Bonds1

About 4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol

4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol (PubChem CID 106650847) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol.

Molecular Properties

Compound Name4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol
PubChem CID106650847
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol
SMILESCN1CCC(O)(C2=CCCCCC2)CC1
InChIInChI=1S/C13H23NO/c1-14-10-8-13(15,9-11-14)12-6-4-2-3-5-7-12/h6,15H,2-5,7-11H2,1H3
InChIKeyAQINZABVQROIKL-UHFFFAOYSA-N
XLogP2.33
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[(E)-but-1-enyl]-1,2,2,6,6-pentamethylpiperidin-4-ol
CID 20501086
4-But-1-enyl-1,2,2,6,6-pentamethylpiperidin-4-ol
CID 54144531
1,2,2,6,6-Pentamethyl-4-prop-1-enylpiperidin-4-ol
CID 54237835
(Dimethylaminoethyl)bis(1-cyclohexenyl)-methanol
CID 54563448
1,2,2,6,6-pentamethyl-4-[(Z)-prop-1-enyl]piperidin-4-ol
CID 70524040
ethane;4-[(3E,5Z)-hepta-3,5-dien-3-yl]-1-methylpiperidin-4-ol
CID 141949905
4-Cyclohepta-1,3,5-trien-1-yl-1-methylpiperidin-4-ol
CID 142096230
1,2-Dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol
CID 81611309
7-(2-methylprop-1-enyl)-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-ol
CID 81611936
4-(Cycloocten-1-yl)-1-methylpiperidin-4-ol
CID 106650845
4-(Cyclohexen-1-yl)-1-methylpiperidin-4-ol
CID 106650846
4-(Cycloocten-1-yl)-1-ethylpiperidin-4-ol
CID 106650848

Frequently Asked Questions

What is the IUPAC name of 4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol?
The IUPAC name of 4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol (CID 106650847) is 4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol.
What is the SMILES notation for 4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol?
The canonical SMILES for 4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol is CN1CCC(O)(C2=CCCCCC2)CC1.
What is the InChIKey of 4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol?
The InChIKey is AQINZABVQROIKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-14-10-8-13(15,9-11-14)12-6-4-2-3-5-7-12/h6,15H,2-5,7-11H2,1H3.
What are the key properties of 4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol?
4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol has a molecular weight of 209.33 g/mol, XLogP of 2.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclohepten-1-yl)-1-methylpiperidin-4-ol is sourced from PubChem (CID 106650847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).