2,5-dimethyl-1-prop-2-enylpiperidin-4-ol

C10H19NO — CID 10920927

IUPAC2,5-dimethyl-1-prop-2-enylpiperidin-4-ol
SMILESC=CCN1CC(C)C(O)CC1C
InChIInChI=1S/C10H19NO/c1-4-5-11-7-8(2)10(12)6-9(11)3/h4,8-10,12H,1,5-7H2,2-3H3
InChIKeyIEFWBNNEUNBEAY-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.26
Rot. Bonds2

About 2,5-dimethyl-1-prop-2-enylpiperidin-4-ol

2,5-dimethyl-1-prop-2-enylpiperidin-4-ol (PubChem CID 10920927) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2,5-dimethyl-1-prop-2-enylpiperidin-4-ol.

Molecular Properties

Compound Name2,5-dimethyl-1-prop-2-enylpiperidin-4-ol
PubChem CID10920927
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2,5-dimethyl-1-prop-2-enylpiperidin-4-ol
SMILESC=CCN1CC(C)C(O)CC1C
InChIInChI=1S/C10H19NO/c1-4-5-11-7-8(2)10(12)6-9(11)3/h4,8-10,12H,1,5-7H2,2-3H3
InChIKeyIEFWBNNEUNBEAY-UHFFFAOYSA-N
XLogP1.26
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 ≤ 51.26
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 2,5-dimethyl-1-prop-2-enylpiperidin-4-ol?
The IUPAC name of 2,5-dimethyl-1-prop-2-enylpiperidin-4-ol (CID 10920927) is 2,5-dimethyl-1-prop-2-enylpiperidin-4-ol.
What is the SMILES notation for 2,5-dimethyl-1-prop-2-enylpiperidin-4-ol?
The canonical SMILES for 2,5-dimethyl-1-prop-2-enylpiperidin-4-ol is C=CCN1CC(C)C(O)CC1C.
What is the InChIKey of 2,5-dimethyl-1-prop-2-enylpiperidin-4-ol?
The InChIKey is IEFWBNNEUNBEAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-4-5-11-7-8(2)10(12)6-9(11)3/h4,8-10,12H,1,5-7H2,2-3H3.
What are the key properties of 2,5-dimethyl-1-prop-2-enylpiperidin-4-ol?
2,5-dimethyl-1-prop-2-enylpiperidin-4-ol has a molecular weight of 169.27 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1-prop-2-enylpiperidin-4-ol is sourced from PubChem (CID 10920927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).