3-(piperidin-4-ylmethylamino)cyclobutan-1-ol

C10H20N2O — CID 79707508

IUPAC3-(piperidin-4-ylmethylamino)cyclobutan-1-ol
SMILESOC1CC(NCC2CCNCC2)C1
InChIInChI=1S/C10H20N2O/c13-10-5-9(6-10)12-7-8-1-3-11-4-2-8/h8-13H,1-7H2
InChIKeyWLFAZJQHACUEQU-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.10
Rot. Bonds3

About 3-(piperidin-4-ylmethylamino)cyclobutan-1-ol

3-(piperidin-4-ylmethylamino)cyclobutan-1-ol (PubChem CID 79707508) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-(piperidin-4-ylmethylamino)cyclobutan-1-ol.

Molecular Properties

Compound Name3-(piperidin-4-ylmethylamino)cyclobutan-1-ol
PubChem CID79707508
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name3-(piperidin-4-ylmethylamino)cyclobutan-1-ol
SMILESOC1CC(NCC2CCNCC2)C1
InChIInChI=1S/C10H20N2O/c13-10-5-9(6-10)12-7-8-1-3-11-4-2-8/h8-13H,1-7H2
InChIKeyWLFAZJQHACUEQU-UHFFFAOYSA-N
XLogP0.10
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(piperidin-4-ylmethylamino)cyclobutan-1-ol?
The IUPAC name of 3-(piperidin-4-ylmethylamino)cyclobutan-1-ol (CID 79707508) is 3-(piperidin-4-ylmethylamino)cyclobutan-1-ol.
What is the SMILES notation for 3-(piperidin-4-ylmethylamino)cyclobutan-1-ol?
The canonical SMILES for 3-(piperidin-4-ylmethylamino)cyclobutan-1-ol is OC1CC(NCC2CCNCC2)C1.
What is the InChIKey of 3-(piperidin-4-ylmethylamino)cyclobutan-1-ol?
The InChIKey is WLFAZJQHACUEQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c13-10-5-9(6-10)12-7-8-1-3-11-4-2-8/h8-13H,1-7H2.
What are the key properties of 3-(piperidin-4-ylmethylamino)cyclobutan-1-ol?
3-(piperidin-4-ylmethylamino)cyclobutan-1-ol has a molecular weight of 184.28 g/mol, XLogP of 0.10, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperidin-4-ylmethylamino)cyclobutan-1-ol is sourced from PubChem (CID 79707508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).