1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol

C17H25NO — CID 71854319

IUPAC1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol
SMILESOC1(CN2CCC(Cc3ccccc3)CC2)CCC1
InChIInChI=1S/C17H25NO/c19-17(9-4-10-17)14-18-11-7-16(8-12-18)13-15-5-2-1-3-6-15/h1-3,5-6,16,19H,4,7-14H2
InChIKeyUPRBARHIPOKHAK-UHFFFAOYSA-N
MW259.39 g/mol
LogP2.86
Rot. Bonds4

About 1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol

1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol (PubChem CID 71854319) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol.

Molecular Properties

Compound Name1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol
PubChem CID71854319
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol
SMILESOC1(CN2CCC(Cc3ccccc3)CC2)CCC1
InChIInChI=1S/C17H25NO/c19-17(9-4-10-17)14-18-11-7-16(8-12-18)13-15-5-2-1-3-6-15/h1-3,5-6,16,19H,4,7-14H2
InChIKeyUPRBARHIPOKHAK-UHFFFAOYSA-N
XLogP2.86
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-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-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol?
The IUPAC name of 1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol (CID 71854319) is 1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol.
What is the SMILES notation for 1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol?
The canonical SMILES for 1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol is OC1(CN2CCC(Cc3ccccc3)CC2)CCC1.
What is the InChIKey of 1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol?
The InChIKey is UPRBARHIPOKHAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c19-17(9-4-10-17)14-18-11-7-16(8-12-18)13-15-5-2-1-3-6-15/h1-3,5-6,16,19H,4,7-14H2.
What are the key properties of 1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol?
1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol has a molecular weight of 259.39 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-benzylpiperidin-1-yl)methyl]cyclobutan-1-ol is sourced from PubChem (CID 71854319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).