1-(3-methylbut-2-enyl)piperidin-4-ol

C10H19NO — CID 43226353

IUPAC1-(3-methylbut-2-enyl)piperidin-4-ol
SMILESCC(C)=CCN1CCC(O)CC1
InChIInChI=1S/C10H19NO/c1-9(2)3-6-11-7-4-10(12)5-8-11/h3,10,12H,4-8H2,1-2H3
InChIKeyKJOKXRRRIAIZSM-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.41
Rot. Bonds2

About 1-(3-methylbut-2-enyl)piperidin-4-ol

1-(3-methylbut-2-enyl)piperidin-4-ol (PubChem CID 43226353) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-(3-methylbut-2-enyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(3-methylbut-2-enyl)piperidin-4-ol
PubChem CID43226353
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-(3-methylbut-2-enyl)piperidin-4-ol
SMILESCC(C)=CCN1CCC(O)CC1
InChIInChI=1S/C10H19NO/c1-9(2)3-6-11-7-4-10(12)5-8-11/h3,10,12H,4-8H2,1-2H3
InChIKeyKJOKXRRRIAIZSM-UHFFFAOYSA-N
XLogP1.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methylbut-2-enyl)piperidin-4-ol?
The IUPAC name of 1-(3-methylbut-2-enyl)piperidin-4-ol (CID 43226353) is 1-(3-methylbut-2-enyl)piperidin-4-ol.
What is the SMILES notation for 1-(3-methylbut-2-enyl)piperidin-4-ol?
The canonical SMILES for 1-(3-methylbut-2-enyl)piperidin-4-ol is CC(C)=CCN1CCC(O)CC1.
What is the InChIKey of 1-(3-methylbut-2-enyl)piperidin-4-ol?
The InChIKey is KJOKXRRRIAIZSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-9(2)3-6-11-7-4-10(12)5-8-11/h3,10,12H,4-8H2,1-2H3.
What are the key properties of 1-(3-methylbut-2-enyl)piperidin-4-ol?
1-(3-methylbut-2-enyl)piperidin-4-ol has a molecular weight of 169.27 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylbut-2-enyl)piperidin-4-ol is sourced from PubChem (CID 43226353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).