4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine

C17H26N2S — CID 171335572

IUPAC4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine
SMILESCC(c1ccccc1)N1CCC(N2CCSCC2)CC1
InChIInChI=1S/C17H26N2S/c1-15(16-5-3-2-4-6-16)18-9-7-17(8-10-18)19-11-13-20-14-12-19/h2-6,15,17H,7-14H2,1H3
InChIKeyHZQJGFNIURFELR-UHFFFAOYSA-N
MW290.48 g/mol
LogP3.26
Rot. Bonds3

About 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine

4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine (PubChem CID 171335572) has the molecular formula C17H26N2S and a molecular weight of 290.48 g/mol. Its IUPAC name is 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine.

Molecular Properties

Compound Name4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine
PubChem CID171335572
Molecular FormulaC17H26N2S
Molecular Weight290.48 g/mol
Exact Mass290.18
IUPAC Name4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine
SMILESCC(c1ccccc1)N1CCC(N2CCSCC2)CC1
InChIInChI=1S/C17H26N2S/c1-15(16-5-3-2-4-6-16)18-9-7-17(8-10-18)19-11-13-20-14-12-19/h2-6,15,17H,7-14H2,1H3
InChIKeyHZQJGFNIURFELR-UHFFFAOYSA-N
XLogP3.26
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.48
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine 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-[(1S)-1-phenylethyl]-4-[(1R)-1-phenylethyl]piperazine
CID 3246046
1-(1-phenylethyl)piperidin-4-amine
CID 12641844
3-[(1R)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]pyridine
CID 95276591
1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine
CID 134380011
N,N-dimethyl-2-[1-(1-phenylethyl)piperidin-4-yl]ethanamine
CID 60542956
1-[(1S)-1-phenylethyl]pyrrolidin-3-ol
CID 69382807
(2R)-2-(4-hydroxyphenyl)-2-(4-thiomorpholin-4-ylpiperidin-1-yl)acetic acid
CID 97282266
1-[1-[4-(benzenesulfonyl)phenyl]ethyl]-4-cyclohexylpiperazine
CID 15392110
1-amino-N-[1-(1-phenylethyl)piperidin-4-yl]cyclopropane-1-carboxamide
CID 119879171
1-[1-[1-(4-methoxyphenyl)ethyl]piperidin-4-yl]-4-(2-methylphenyl)piperazine
CID 46851398
2-[(3R,4S)-3-hydroxy-1-(1-phenylethyl)piperidin-4-yl]acetonitrile
CID 134280560
1-[(1S)-1-phenylethyl]piperazine;dihydrochloride
CID 57383523

Frequently Asked Questions

What is the IUPAC name of 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine?
The IUPAC name of 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine (CID 171335572) is 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine.
What is the SMILES notation for 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine?
The canonical SMILES for 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine is CC(c1ccccc1)N1CCC(N2CCSCC2)CC1.
What is the InChIKey of 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine?
The InChIKey is HZQJGFNIURFELR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2S/c1-15(16-5-3-2-4-6-16)18-9-7-17(8-10-18)19-11-13-20-14-12-19/h2-6,15,17H,7-14H2,1H3.
What are the key properties of 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine?
4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine has a molecular weight of 290.48 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(1-phenylethyl)piperidin-4-yl]thiomorpholine is sourced from PubChem (CID 171335572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).