1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol

C13H23N3O — CID 56867802

IUPAC1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol
SMILESCC(C)c1nccn1CCN1CCC(O)CC1
InChIInChI=1S/C13H23N3O/c1-11(2)13-14-5-8-16(13)10-9-15-6-3-12(17)4-7-15/h5,8,11-12,17H,3-4,6-7,9-10H2,1-2H3
InChIKeyDJGDCFFZVUJYER-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.46
Rot. Bonds4

About 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol

1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol (PubChem CID 56867802) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol
PubChem CID56867802
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol
SMILESCC(C)c1nccn1CCN1CCC(O)CC1
InChIInChI=1S/C13H23N3O/c1-11(2)13-14-5-8-16(13)10-9-15-6-3-12(17)4-7-15/h5,8,11-12,17H,3-4,6-7,9-10H2,1-2H3
InChIKeyDJGDCFFZVUJYER-UHFFFAOYSA-N
XLogP1.46
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]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

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol?
The IUPAC name of 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol (CID 56867802) is 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol.
What is the SMILES notation for 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol?
The canonical SMILES for 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol is CC(C)c1nccn1CCN1CCC(O)CC1.
What is the InChIKey of 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol?
The InChIKey is DJGDCFFZVUJYER-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-11(2)13-14-5-8-16(13)10-9-15-6-3-12(17)4-7-15/h5,8,11-12,17H,3-4,6-7,9-10H2,1-2H3.
What are the key properties of 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol?
1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol has a molecular weight of 237.35 g/mol, XLogP of 1.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidin-4-ol is sourced from PubChem (CID 56867802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).