1-(4-phenylpiperidin-1-yl)butan-2-ol

C15H23NO — CID 3078235

IUPAC1-(4-phenylpiperidin-1-yl)butan-2-ol
SMILESCCC(O)CN1CCC(c2ccccc2)CC1
InChIInChI=1S/C15H23NO/c1-2-15(17)12-16-10-8-14(9-11-16)13-6-4-3-5-7-13/h3-7,14-15,17H,2,8-12H2,1H3
InChIKeyCZOVPNVTVNILDM-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.64
Rot. Bonds4

About 1-(4-phenylpiperidin-1-yl)butan-2-ol

1-(4-phenylpiperidin-1-yl)butan-2-ol (PubChem CID 3078235) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-(4-phenylpiperidin-1-yl)butan-2-ol.

Molecular Properties

Compound Name1-(4-phenylpiperidin-1-yl)butan-2-ol
PubChem CID3078235
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-(4-phenylpiperidin-1-yl)butan-2-ol
SMILESCCC(O)CN1CCC(c2ccccc2)CC1
InChIInChI=1S/C15H23NO/c1-2-15(17)12-16-10-8-14(9-11-16)13-6-4-3-5-7-13/h3-7,14-15,17H,2,8-12H2,1H3
InChIKeyCZOVPNVTVNILDM-UHFFFAOYSA-N
XLogP2.64
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-phenylpiperidin-1-yl)butan-2-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-phenylpiperidin-1-yl)butan-2-ol?
The IUPAC name of 1-(4-phenylpiperidin-1-yl)butan-2-ol (CID 3078235) is 1-(4-phenylpiperidin-1-yl)butan-2-ol.
What is the SMILES notation for 1-(4-phenylpiperidin-1-yl)butan-2-ol?
The canonical SMILES for 1-(4-phenylpiperidin-1-yl)butan-2-ol is CCC(O)CN1CCC(c2ccccc2)CC1.
What is the InChIKey of 1-(4-phenylpiperidin-1-yl)butan-2-ol?
The InChIKey is CZOVPNVTVNILDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-15(17)12-16-10-8-14(9-11-16)13-6-4-3-5-7-13/h3-7,14-15,17H,2,8-12H2,1H3.
What are the key properties of 1-(4-phenylpiperidin-1-yl)butan-2-ol?
1-(4-phenylpiperidin-1-yl)butan-2-ol has a molecular weight of 233.36 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenylpiperidin-1-yl)butan-2-ol is sourced from PubChem (CID 3078235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).