5-methylpiperidin-3-ol

C6H13NO — CID 21278329

IUPAC5-methylpiperidin-3-ol
SMILESCC1CNCC(O)C1
InChIInChI=1S/C6H13NO/c1-5-2-6(8)4-7-3-5/h5-8H,2-4H2,1H3
InChIKeyQDPYHRSTDJTFRG-UHFFFAOYSA-N
MW115.18 g/mol
LogP-0.02
Rot. Bonds

About 5-methylpiperidin-3-ol

5-methylpiperidin-3-ol (PubChem CID 21278329) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 5-methylpiperidin-3-ol.

Molecular Properties

Compound Name5-methylpiperidin-3-ol
PubChem CID21278329
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name5-methylpiperidin-3-ol
SMILESCC1CNCC(O)C1
InChIInChI=1S/C6H13NO/c1-5-2-6(8)4-7-3-5/h5-8H,2-4H2,1H3
InChIKeyQDPYHRSTDJTFRG-UHFFFAOYSA-N
XLogP-0.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-methylpiperidin-3-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 5-methylpiperidin-3-ol?
The IUPAC name of 5-methylpiperidin-3-ol (CID 21278329) is 5-methylpiperidin-3-ol.
What is the SMILES notation for 5-methylpiperidin-3-ol?
The canonical SMILES for 5-methylpiperidin-3-ol is CC1CNCC(O)C1.
What is the InChIKey of 5-methylpiperidin-3-ol?
The InChIKey is QDPYHRSTDJTFRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-5-2-6(8)4-7-3-5/h5-8H,2-4H2,1H3.
What are the key properties of 5-methylpiperidin-3-ol?
5-methylpiperidin-3-ol has a molecular weight of 115.18 g/mol, XLogP of -0.02, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylpiperidin-3-ol is sourced from PubChem (CID 21278329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).