4-methyl-2-piperidin-3-ylpent-3-en-2-ol

C11H21NO — CID 79190336

IUPAC4-methyl-2-piperidin-3-ylpent-3-en-2-ol
SMILESCC(C)=CC(C)(O)C1CCCNC1
InChIInChI=1S/C11H21NO/c1-9(2)7-11(3,13)10-5-4-6-12-8-10/h7,10,12-13H,4-6,8H2,1-3H3
InChIKeyYPFHYGCKWZCPCV-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.70
Rot. Bonds2

About 4-methyl-2-piperidin-3-ylpent-3-en-2-ol

4-methyl-2-piperidin-3-ylpent-3-en-2-ol (PubChem CID 79190336) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-methyl-2-piperidin-3-ylpent-3-en-2-ol.

Molecular Properties

Compound Name4-methyl-2-piperidin-3-ylpent-3-en-2-ol
PubChem CID79190336
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-methyl-2-piperidin-3-ylpent-3-en-2-ol
SMILESCC(C)=CC(C)(O)C1CCCNC1
InChIInChI=1S/C11H21NO/c1-9(2)7-11(3,13)10-5-4-6-12-8-10/h7,10,12-13H,4-6,8H2,1-3H3
InChIKeyYPFHYGCKWZCPCV-UHFFFAOYSA-N
XLogP1.70
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.70
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

(3R)-3-tert-butylpiperidine
CID 59772800
1-cycloheptyl-1-piperidin-3-ylethanol
CID 82929213
2-piperidin-3-ylbutan-2-ol
CID 63586087
(2S)-2-[(3R)-piperidin-3-yl]propane-1,2-diol
CID 171842996
5,5-dimethyl-2-piperidin-3-ylhexan-2-ol
CID 65146059
2-piperidin-3-ylpentan-2-ol
CID 63586269
2-hydroxy-2-piperidin-3-ylpropanenitrile
CID 173142831
piperidin-3-ol;propane-2,2-diol
CID 142962358
2-methyl-2-piperidin-3-ylpropan-1-ol
CID 83200214
1-(4-tert-butylphenyl)-1-piperidin-3-ylethanol
CID 63586623
2-piperidin-3-yloctan-2-ol
CID 65146111
4-amino-3,3-dimethyl-2-piperidin-3-ylbutan-2-ol
CID 79135325

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-piperidin-3-ylpent-3-en-2-ol?
The IUPAC name of 4-methyl-2-piperidin-3-ylpent-3-en-2-ol (CID 79190336) is 4-methyl-2-piperidin-3-ylpent-3-en-2-ol.
What is the SMILES notation for 4-methyl-2-piperidin-3-ylpent-3-en-2-ol?
The canonical SMILES for 4-methyl-2-piperidin-3-ylpent-3-en-2-ol is CC(C)=CC(C)(O)C1CCCNC1.
What is the InChIKey of 4-methyl-2-piperidin-3-ylpent-3-en-2-ol?
The InChIKey is YPFHYGCKWZCPCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(2)7-11(3,13)10-5-4-6-12-8-10/h7,10,12-13H,4-6,8H2,1-3H3.
What are the key properties of 4-methyl-2-piperidin-3-ylpent-3-en-2-ol?
4-methyl-2-piperidin-3-ylpent-3-en-2-ol has a molecular weight of 183.29 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-piperidin-3-ylpent-3-en-2-ol is sourced from PubChem (CID 79190336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).