4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine

C10H19FN2S — CID 164646625

IUPAC4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine
SMILESCC1CSCCN1C1CCNCC1F
InChIInChI=1S/C10H19FN2S/c1-8-7-14-5-4-13(8)10-2-3-12-6-9(10)11/h8-10,12H,2-7H2,1H3
InChIKeyUZAFTPVDHCCTBC-UHFFFAOYSA-N
MW218.34 g/mol
LogP1.12
Rot. Bonds1

About 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine

4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine (PubChem CID 164646625) has the molecular formula C10H19FN2S and a molecular weight of 218.34 g/mol. Its IUPAC name is 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine.

Molecular Properties

Compound Name4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine
PubChem CID164646625
Molecular FormulaC10H19FN2S
Molecular Weight218.34 g/mol
Exact Mass218.13
IUPAC Name4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine
SMILESCC1CSCCN1C1CCNCC1F
InChIInChI=1S/C10H19FN2S/c1-8-7-14-5-4-13(8)10-2-3-12-6-9(10)11/h8-10,12H,2-7H2,1H3
InChIKeyUZAFTPVDHCCTBC-UHFFFAOYSA-N
XLogP1.12
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine 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-(4-Piperidinyl)thiomorpholine dihydrochloride
CID 47000644
1-(tetrahydro-2H-thiopyran-4-yl)piperidin-4-amine
CID 45791253
N-[2-(propylthio)ethyl]piperidin-4-amine
CID 56722598
3,3-difluoro-1-methyl-N-(thian-4-yl)piperidin-4-amine;ethane
CID 178688384
1-Methyl-N-[3-(methylsulfanyl)propyl]piperidin-4-amine
CID 43216125
N-(2-methylsulfanylethyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 63980758
N-(2-methyl-3-methylsulfanylpropyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 63981310
N-(3-methylsulfanylpropyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 63983391
3-[2-[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]ethyl]thiomorpholine
CID 66419968
3,3,3-trifluoro-N-methyl-N-(2-thiomorpholin-3-ylethyl)propan-1-amine
CID 66420561
3-[2-[3-(Trifluoromethyl)piperidin-1-yl]ethyl]thiomorpholine
CID 66420755
3-[2-[4-(Trifluoromethyl)piperidin-1-yl]ethyl]thiomorpholine
CID 66420756

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine?
The IUPAC name of 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine (CID 164646625) is 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine.
What is the SMILES notation for 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine?
The canonical SMILES for 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine is CC1CSCCN1C1CCNCC1F.
What is the InChIKey of 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine?
The InChIKey is UZAFTPVDHCCTBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2S/c1-8-7-14-5-4-13(8)10-2-3-12-6-9(10)11/h8-10,12H,2-7H2,1H3.
What are the key properties of 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine?
4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine has a molecular weight of 218.34 g/mol, XLogP of 1.12, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoropiperidin-4-yl)-3-methylthiomorpholine is sourced from PubChem (CID 164646625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).