1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol

C11H21NO — CID 130878903

IUPAC1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol
SMILESCC(C)=CC1(O)CCN(C)CC1C
InChIInChI=1S/C11H21NO/c1-9(2)7-11(13)5-6-12(4)8-10(11)3/h7,10,13H,5-6,8H2,1-4H3
InChIKeyUJPHBAVIBVBMNF-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.66
Rot. Bonds1

About 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol

1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol (PubChem CID 130878903) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol.

Molecular Properties

Compound Name1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol
PubChem CID130878903
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol
SMILESCC(C)=CC1(O)CCN(C)CC1C
InChIInChI=1S/C11H21NO/c1-9(2)7-11(13)5-6-12(4)8-10(11)3/h7,10,13H,5-6,8H2,1-4H3
InChIKeyUJPHBAVIBVBMNF-UHFFFAOYSA-N
XLogP1.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(Z)-3-hydroxy-3-methylbut-1-enyl]-1-methylpiperidin-4-ol;hydrochloride
CID 12283011
4-(3-Hydroxy-3-methyl-1-butenyl)-1-methyl-4-piperidinol
CID 12283012
4-[(2E,4Z)-6-fluorohepta-2,4,6-trien-3-yl]-1-methylpiperidin-4-ol
CID 134365797
1-methyl-4-[(E)-4,4,4-trifluorobut-1-enyl]piperidin-4-ol
CID 146582433
2,5-Heptadien-4-ol, 3,5-dimethyl-4-[2-(pyrrolidin-1-yl)ethyl]-
CID 5367883
3,5-Dimethyl-4-(2-pyrrolidin-1-ylethyl)hepta-2,5-dien-4-ol
CID 558665
4-Hydroxy-4-(dimethylamino-ethyl)-3,5-dimethyl-2,5-heptadiene
CID 54506043
4-Cyclohepta-1,3,6-trien-1-yl-1-methylpiperidin-4-ol
CID 58361231
4-But-2-en-2-yl-1-methylpiperidin-4-ol
CID 91525335
4-[(3E,5Z)-hepta-1,3,5-trien-4-yl]-1-methylpiperidin-4-ol
CID 134365800
4-(3,4-Dimethylcyclohexa-1,5-dien-1-yl)-1-methylpiperidin-4-ol
CID 141791942
ethane;4-[(2E,4Z)-hepta-2,4,6-trien-3-yl]-1-methylpiperidin-4-ol
CID 141848831

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol?
The IUPAC name of 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol (CID 130878903) is 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol.
What is the SMILES notation for 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol?
The canonical SMILES for 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol is CC(C)=CC1(O)CCN(C)CC1C.
What is the InChIKey of 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol?
The InChIKey is UJPHBAVIBVBMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(2)7-11(13)5-6-12(4)8-10(11)3/h7,10,13H,5-6,8H2,1-4H3.
What are the key properties of 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol?
1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol has a molecular weight of 183.29 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4-(2-methylprop-1-enyl)piperidin-4-ol is sourced from PubChem (CID 130878903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).