2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol

C15H23NO — CID 82166020

IUPAC2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol
SMILESCC(C)(O)c1ccc(CN2CCCCC2)cc1
InChIInChI=1S/C15H23NO/c1-15(2,17)14-8-6-13(7-9-14)12-16-10-4-3-5-11-16/h6-9,17H,3-5,10-12H2,1-2H3
InChIKeyUMGGDNUPCQVFDG-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.90
Rot. Bonds3

About 2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol

2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol (PubChem CID 82166020) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol.

Molecular Properties

Compound Name2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol
PubChem CID82166020
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol
SMILESCC(C)(O)c1ccc(CN2CCCCC2)cc1
InChIInChI=1S/C15H23NO/c1-15(2,17)14-8-6-13(7-9-14)12-16-10-4-3-5-11-16/h6-9,17H,3-5,10-12H2,1-2H3
InChIKeyUMGGDNUPCQVFDG-UHFFFAOYSA-N
XLogP2.90
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[4-(piperidin-1-ylmethyl)phenyl]propan-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

Related Compounds

1-[(4-methylphenyl)methyl]azepane
CID 3951815
2,2-dimethyl-1-[4-(piperidin-1-ylmethyl)phenyl]propan-1-one
CID 158551228
ethane;1-[(4-methylphenyl)methyl]piperidine
CID 143603243
N-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)-4-(piperidin-1-ylmethyl)benzamide
CID 166236360
4-(piperidin-1-ylmethyl)benzenethiol
CID 46785612
4-(azacyclododec-1-ylmethyl)aniline
CID 70405299
N-methyl-4-(piperidin-1-ylmethyl)aniline
CID 18319987
1-benzylazepane
CID 10954328
sodium [4-(piperidin-1-ylmethyl)phenyl]methanolate
CID 86608799
1-[[4-(bromomethyl)phenyl]methyl]piperidine;hydrobromide
CID 163358516
[4-(piperidin-1-ylmethyl)phenyl]boronic acid;hydrochloride
CID 56773619
1-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-2-methylpropan-2-ol
CID 110932473

Frequently Asked Questions

What is the IUPAC name of 2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol?
The IUPAC name of 2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol (CID 82166020) is 2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol.
What is the SMILES notation for 2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol?
The canonical SMILES for 2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol is CC(C)(O)c1ccc(CN2CCCCC2)cc1.
What is the InChIKey of 2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol?
The InChIKey is UMGGDNUPCQVFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-15(2,17)14-8-6-13(7-9-14)12-16-10-4-3-5-11-16/h6-9,17H,3-5,10-12H2,1-2H3.
What are the key properties of 2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol?
2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol has a molecular weight of 233.36 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(piperidin-1-ylmethyl)phenyl]propan-2-ol is sourced from PubChem (CID 82166020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).