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

C13H23NO — CID 106651720

IUPACcyclohepten-1-yl(piperidin-2-yl)methanol
SMILESOC(C1=CCCCCC1)C1CCCCN1
InChIInChI=1S/C13H23NO/c15-13(12-9-5-6-10-14-12)11-7-3-1-2-4-8-11/h7,12-15H,1-6,8-10H2
InChIKeyMZBGOOYPFXTNRV-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.38
Rot. Bonds2

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

cyclohepten-1-yl(piperidin-2-yl)methanol (PubChem CID 106651720) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is cyclohepten-1-yl(piperidin-2-yl)methanol.

Molecular Properties

Compound Namecyclohepten-1-yl(piperidin-2-yl)methanol
PubChem CID106651720
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Namecyclohepten-1-yl(piperidin-2-yl)methanol
SMILESOC(C1=CCCCCC1)C1CCCCN1
InChIInChI=1S/C13H23NO/c15-13(12-9-5-6-10-14-12)11-7-3-1-2-4-8-11/h7,12-15H,1-6,8-10H2
InChIKeyMZBGOOYPFXTNRV-UHFFFAOYSA-N
XLogP2.38
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.38
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

cis-(1R,2R,6Z)-2-(butylamino)-6-tetradecylidenecyclohexan-1-ol
CID 24936063
(E)-1-piperidin-2-ylpent-3-en-2-ol
CID 6377936
3-(Hydroxymethyl)-1,2,3,4,6,7,8,8a-octahydroisoquinolin-4-ol
CID 11492056
1,2,3,4,8,8a-Hexahydroquinolin-8-ol
CID 67297178
(4S)-3-(hydroxymethyl)-1,2,3,4,6,7,8,8a-octahydroisoquinolin-4-ol
CID 69703760
(3S)-3-(hydroxymethyl)-1,2,3,4,6,7,8,8a-octahydroisoquinolin-4-ol
CID 69703761
6-(Cyclopropen-1-ylmethyl)piperidin-3-ol
CID 91348641
N-[(1R,2R)-4-ethyl-2-hydroxycyclohex-3-en-1-yl]acetamide
CID 118920479
1-(Cyclohexen-1-yl)-1-(methylamino)propan-2-ol
CID 123328567
(2E,3Z)-1-(azepan-2-yl)-2-ethylidenehexa-3,5-dien-1-ol
CID 155088663
2-[(3Z)-2-methylidenehexa-3,5-dienyl]piperidin-3-ol
CID 156749674
3-(5-Methylpiperidin-2-yl)cyclohex-2-en-1-ol
CID 164752961

Frequently Asked Questions

What is the IUPAC name of cyclohepten-1-yl(piperidin-2-yl)methanol?
The IUPAC name of cyclohepten-1-yl(piperidin-2-yl)methanol (CID 106651720) is cyclohepten-1-yl(piperidin-2-yl)methanol.
What is the SMILES notation for cyclohepten-1-yl(piperidin-2-yl)methanol?
The canonical SMILES for cyclohepten-1-yl(piperidin-2-yl)methanol is OC(C1=CCCCCC1)C1CCCCN1.
What is the InChIKey of cyclohepten-1-yl(piperidin-2-yl)methanol?
The InChIKey is MZBGOOYPFXTNRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c15-13(12-9-5-6-10-14-12)11-7-3-1-2-4-8-11/h7,12-15H,1-6,8-10H2.
What are the key properties of cyclohepten-1-yl(piperidin-2-yl)methanol?
cyclohepten-1-yl(piperidin-2-yl)methanol has a molecular weight of 209.33 g/mol, XLogP of 2.38, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohepten-1-yl(piperidin-2-yl)methanol is sourced from PubChem (CID 106651720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).