1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol

C15H29NO — CID 143571269

IUPAC1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol
SMILESC1CCC(CN2CCCCC2)CC1.C=CCO
InChIInChI=1S/C12H23N.C3H6O/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;1-2-3-4/h12H,1-11H2;2,4H,1,3H2
InChIKeySEUOGYINLOBROC-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.22
Rot. Bonds3

About 1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol

1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol (PubChem CID 143571269) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol.

Molecular Properties

Compound Name1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol
PubChem CID143571269
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol
SMILESC1CCC(CN2CCCCC2)CC1.C=CCO
InChIInChI=1S/C12H23N.C3H6O/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;1-2-3-4/h12H,1-11H2;2,4H,1,3H2
InChIKeySEUOGYINLOBROC-UHFFFAOYSA-N
XLogP3.22
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.22
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

1-(4-Propan-2-ylpiperidin-1-yl)prop-2-en-1-ol
CID 135134247
1-(4-Methylpiperidin-1-yl)prop-2-en-1-ol
CID 143928892
1-[(3S)-1,3-dimethylpiperidin-1-ium-1-yl]prop-2-en-1-ol
CID 156867604
1-(3-Methylpiperidin-1-yl)prop-2-en-1-ol
CID 166841023
1-(Cyclohexylmethyl)-4-methylpiperidine;ethane;prop-2-en-1-ol
CID 176925507
3-[Cyclohexylmethyl(prop-2-enyl)amino]propan-1-ol
CID 111118062
2-[Cyclohexylmethyl(prop-2-enyl)amino]ethanol
CID 115631946

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol?
The IUPAC name of 1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol (CID 143571269) is 1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol.
What is the SMILES notation for 1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol?
The canonical SMILES for 1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol is C1CCC(CN2CCCCC2)CC1.C=CCO.
What is the InChIKey of 1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol?
The InChIKey is SEUOGYINLOBROC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N.C3H6O/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;1-2-3-4/h12H,1-11H2;2,4H,1,3H2.
What are the key properties of 1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol?
1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol has a molecular weight of 239.40 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)piperidine;prop-2-en-1-ol is sourced from PubChem (CID 143571269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).