[1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol

C18H28N2O — CID 23911512

IUPAC[1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C18H28N2O/c21-15-18-7-4-11-20(18)17-9-13-19(14-10-17)12-8-16-5-2-1-3-6-16/h1-3,5-6,17-18,21H,4,7-15H2
InChIKeyWRTUWLCILMJTCA-UHFFFAOYSA-N
MW288.43 g/mol
LogP2.15
Rot. Bonds5

About [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol

[1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol (PubChem CID 23911512) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol
PubChem CID23911512
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC Name[1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C18H28N2O/c21-15-18-7-4-11-20(18)17-9-13-19(14-10-17)12-8-16-5-2-1-3-6-16/h1-3,5-6,17-18,21H,4,7-15H2
InChIKeyWRTUWLCILMJTCA-UHFFFAOYSA-N
XLogP2.15
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol 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-(2-phenylethyl)pyrrolidin-2-yl]methanol
CID 13404761
(3S)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-3-ol
CID 7047301
[(2R)-1-(2-phenylethyl)piperidin-2-yl]methanol
CID 26457952
(3S)-3-methyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidine
CID 7047234
1-[1-(2-phenylethyl)piperidin-4-yl]ethanol
CID 103656947
hypochlorous acid;1-(2-phenylethyl)piperidin-4-amine
CID 159010718
(3aS,6aS)-1-[1-(2-phenylethyl)piperidin-4-yl]-3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[3,4-b]pyrrole
CID 121497137
1,4-bis(2-phenylethyl)piperidine
CID 86059939
4-phenyl-1-(2-phenylethyl)piperidine
CID 54327803
1-(2-phenylethyl)-4-propan-2-ylpiperidine
CID 18683008
1-(2-phenylethyl)-N-pyrrol-1-ylpiperidin-4-amine
CID 13306762
(3S)-N-cyclopropyl-1-[1-(2-phenylethyl)piperidin-4-yl]piperidine-3-carboxamide
CID 25298624

Frequently Asked Questions

What is the IUPAC name of [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol?
The IUPAC name of [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol (CID 23911512) is [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol is OCC1CCCN1C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol?
The InChIKey is WRTUWLCILMJTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c21-15-18-7-4-11-20(18)17-9-13-19(14-10-17)12-8-16-5-2-1-3-6-16/h1-3,5-6,17-18,21H,4,7-15H2.
What are the key properties of [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol?
[1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol has a molecular weight of 288.43 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[1-(2-phenylethyl)piperidin-4-yl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 23911512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).