3-methyl-5-(thiolan-1-ylideneamino)piperidine

C10H20N2S — CID 155755200

IUPAC3-methyl-5-(thiolan-1-ylideneamino)piperidine
SMILESCC1CNCC(N=S2CCCC2)C1
InChIInChI=1S/C10H20N2S/c1-9-6-10(8-11-7-9)12-13-4-2-3-5-13/h9-11H,2-8H2,1H3
InChIKeyUFAJJKVPOVADTE-UHFFFAOYSA-N
MW200.35 g/mol
LogP1.58
Rot. Bonds1

About 3-methyl-5-(thiolan-1-ylideneamino)piperidine

3-methyl-5-(thiolan-1-ylideneamino)piperidine (PubChem CID 155755200) has the molecular formula C10H20N2S and a molecular weight of 200.35 g/mol. Its IUPAC name is 3-methyl-5-(thiolan-1-ylideneamino)piperidine.

Molecular Properties

Compound Name3-methyl-5-(thiolan-1-ylideneamino)piperidine
PubChem CID155755200
Molecular FormulaC10H20N2S
Molecular Weight200.35 g/mol
Exact Mass200.13
IUPAC Name3-methyl-5-(thiolan-1-ylideneamino)piperidine
SMILESCC1CNCC(N=S2CCCC2)C1
InChIInChI=1S/C10H20N2S/c1-9-6-10(8-11-7-9)12-13-4-2-3-5-13/h9-11H,2-8H2,1H3
InChIKeyUFAJJKVPOVADTE-UHFFFAOYSA-N
XLogP1.58
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(thiolan-1-ylideneamino)piperidine?
The IUPAC name of 3-methyl-5-(thiolan-1-ylideneamino)piperidine (CID 155755200) is 3-methyl-5-(thiolan-1-ylideneamino)piperidine.
What is the SMILES notation for 3-methyl-5-(thiolan-1-ylideneamino)piperidine?
The canonical SMILES for 3-methyl-5-(thiolan-1-ylideneamino)piperidine is CC1CNCC(N=S2CCCC2)C1.
What is the InChIKey of 3-methyl-5-(thiolan-1-ylideneamino)piperidine?
The InChIKey is UFAJJKVPOVADTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2S/c1-9-6-10(8-11-7-9)12-13-4-2-3-5-13/h9-11H,2-8H2,1H3.
What are the key properties of 3-methyl-5-(thiolan-1-ylideneamino)piperidine?
3-methyl-5-(thiolan-1-ylideneamino)piperidine has a molecular weight of 200.35 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(thiolan-1-ylideneamino)piperidine is sourced from PubChem (CID 155755200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).