ethane;4-thiomorpholin-4-ylpiperidin-3-amine

C11H25N3S — CID 144642150

IUPACethane;4-thiomorpholin-4-ylpiperidin-3-amine
SMILESCC.NC1CNCCC1N1CCSCC1
InChIInChI=1S/C9H19N3S.C2H6/c10-8-7-11-2-1-9(8)12-3-5-13-6-4-12;1-2/h8-9,11H,1-7,10H2;1-2H3
InChIKeyXVOIOBUJGXSFRZ-UHFFFAOYSA-N
MW231.41 g/mol
LogP0.75
Rot. Bonds1

About ethane;4-thiomorpholin-4-ylpiperidin-3-amine

ethane;4-thiomorpholin-4-ylpiperidin-3-amine (PubChem CID 144642150) has the molecular formula C11H25N3S and a molecular weight of 231.41 g/mol. Its IUPAC name is ethane;4-thiomorpholin-4-ylpiperidin-3-amine.

Molecular Properties

Compound Nameethane;4-thiomorpholin-4-ylpiperidin-3-amine
PubChem CID144642150
Molecular FormulaC11H25N3S
Molecular Weight231.41 g/mol
Exact Mass231.18
IUPAC Nameethane;4-thiomorpholin-4-ylpiperidin-3-amine
SMILESCC.NC1CNCCC1N1CCSCC1
InChIInChI=1S/C9H19N3S.C2H6/c10-8-7-11-2-1-9(8)12-3-5-13-6-4-12;1-2/h8-9,11H,1-7,10H2;1-2H3
InChIKeyXVOIOBUJGXSFRZ-UHFFFAOYSA-N
XLogP0.75
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.41
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze ethane;4-thiomorpholin-4-ylpiperidin-3-amine 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

(3R,4S)-3-methyl-4-pyrrolidin-1-ylpiperidine
CID 67315323
(3R,4R)-4-(1,4-thiazepan-4-yl)pyrrolidin-3-ol
CID 122236789
4-(2-methylpyrazolidin-3-yl)piperidin-3-amine
CID 129134746
4-aminopiperidin-3-ol
CID 54373786
(3R)-3-aminopiperidin-4-ol
CID 52917019
(9S,9aR)-1,3,4,6,7,8,9,9a-octahydropyrido[2,1-c][1,4]thiazin-9-amine
CID 129370543
(3S,4R)-3-methyl-4-pyrrolidin-1-ylpiperidine;dihydrochloride
CID 67315320
3-methyl-4-piperidin-1-ylpiperidine
CID 18457680
1,1-dioxo-4-thiomorpholin-4-ylthiolan-3-amine
CID 62048962
4-[5-(oxetan-3-yl)-2,5-diazabicyclo[4.1.0]heptan-2-yl]piperidin-3-amine
CID 134321617
(3S,4S)-3-aminopiperidin-4-ol;dihydrochloride
CID 171370179
(3R,4R)-4-aminopiperidin-3-ol;dihydrochloride
CID 154804814

Frequently Asked Questions

What is the IUPAC name of ethane;4-thiomorpholin-4-ylpiperidin-3-amine?
The IUPAC name of ethane;4-thiomorpholin-4-ylpiperidin-3-amine (CID 144642150) is ethane;4-thiomorpholin-4-ylpiperidin-3-amine.
What is the SMILES notation for ethane;4-thiomorpholin-4-ylpiperidin-3-amine?
The canonical SMILES for ethane;4-thiomorpholin-4-ylpiperidin-3-amine is CC.NC1CNCCC1N1CCSCC1.
What is the InChIKey of ethane;4-thiomorpholin-4-ylpiperidin-3-amine?
The InChIKey is XVOIOBUJGXSFRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3S.C2H6/c10-8-7-11-2-1-9(8)12-3-5-13-6-4-12;1-2/h8-9,11H,1-7,10H2;1-2H3.
What are the key properties of ethane;4-thiomorpholin-4-ylpiperidin-3-amine?
ethane;4-thiomorpholin-4-ylpiperidin-3-amine has a molecular weight of 231.41 g/mol, XLogP of 0.75, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-thiomorpholin-4-ylpiperidin-3-amine is sourced from PubChem (CID 144642150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).