piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone

C13H24N2OS — CID 119342685

IUPACpiperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone
SMILESCC(C)C1CN(C(=O)C2CCNCC2)CCS1
InChIInChI=1S/C13H24N2OS/c1-10(2)12-9-15(7-8-17-12)13(16)11-3-5-14-6-4-11/h10-12,14H,3-9H2,1-2H3
InChIKeyRAXJIMAHFMMVFO-UHFFFAOYSA-N
MW256.41 g/mol
LogP1.59
Rot. Bonds2

About piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone

piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone (PubChem CID 119342685) has the molecular formula C13H24N2OS and a molecular weight of 256.41 g/mol. Its IUPAC name is piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone.

Molecular Properties

Compound Namepiperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone
PubChem CID119342685
Molecular FormulaC13H24N2OS
Molecular Weight256.41 g/mol
Exact Mass256.16
IUPAC Namepiperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone
SMILESCC(C)C1CN(C(=O)C2CCNCC2)CCS1
InChIInChI=1S/C13H24N2OS/c1-10(2)12-9-15(7-8-17-12)13(16)11-3-5-14-6-4-11/h10-12,14H,3-9H2,1-2H3
InChIKeyRAXJIMAHFMMVFO-UHFFFAOYSA-N
XLogP1.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.41
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone 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

4-(2-propan-2-ylthiomorpholine-4-carbonyl)piperidin-2-one
CID 71918517
piperidin-4-yl-(3-propan-2-ylpyrrolidin-1-yl)methanone;hydrochloride
CID 119344916
piperidin-4-yl-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103797757
morpholin-3-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone
CID 119817036
[(3S)-3-methylpyrrolidin-1-yl]-piperidin-4-ylmethanone
CID 90192135
(3-propan-2-ylpyrrolidin-1-yl)-pyrrolidin-3-ylmethanone
CID 115740808
1-(piperidine-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 63030374
2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone;hydrochloride
CID 119342676
2-amino-1-(2-propan-2-ylthiomorpholin-4-yl)ethanone;hydrochloride
CID 119342682
[4-[(1R)-1-hydroxyethyl]piperidin-1-yl]-piperidin-4-ylmethanone
CID 129371132
[(3S,4R)-3-(hydroxymethyl)-4-methylpyrrolidin-1-yl]-piperidin-4-ylmethanone
CID 129499446
[4-(2-methylpropoxy)piperidin-1-yl]-piperidin-4-ylmethanone
CID 119300129

Frequently Asked Questions

What is the IUPAC name of piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone?
The IUPAC name of piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone (CID 119342685) is piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone.
What is the SMILES notation for piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone?
The canonical SMILES for piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone is CC(C)C1CN(C(=O)C2CCNCC2)CCS1.
What is the InChIKey of piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone?
The InChIKey is RAXJIMAHFMMVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2OS/c1-10(2)12-9-15(7-8-17-12)13(16)11-3-5-14-6-4-11/h10-12,14H,3-9H2,1-2H3.
What are the key properties of piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone?
piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone has a molecular weight of 256.41 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-4-yl-(2-propan-2-ylthiomorpholin-4-yl)methanone is sourced from PubChem (CID 119342685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).