4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine

C10H21N3S — CID 107132351

IUPAC4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine
SMILESCN1CCN(NCC2CCSC2)CC1
InChIInChI=1S/C10H21N3S/c1-12-3-5-13(6-4-12)11-8-10-2-7-14-9-10/h10-11H,2-9H2,1H3
InChIKeyBMFORIYKZAWXNS-UHFFFAOYSA-N
MW215.37 g/mol
LogP0.49
Rot. Bonds3

About 4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine

4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine (PubChem CID 107132351) has the molecular formula C10H21N3S and a molecular weight of 215.37 g/mol. Its IUPAC name is 4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine.

Molecular Properties

Compound Name4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine
PubChem CID107132351
Molecular FormulaC10H21N3S
Molecular Weight215.37 g/mol
Exact Mass215.15
IUPAC Name4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine
SMILESCN1CCN(NCC2CCSC2)CC1
InChIInChI=1S/C10H21N3S/c1-12-3-5-13(6-4-12)11-8-10-2-7-14-9-10/h10-11H,2-9H2,1H3
InChIKeyBMFORIYKZAWXNS-UHFFFAOYSA-N
XLogP0.49
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.37
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(thiolan-3-ylmethyl)morpholin-4-amine
CID 107132352
2-(1-methylpiperidin-4-yl)-N-(thiolan-3-ylmethyl)ethanamine
CID 107132495
4-methyl-N-(thiolan-3-yl)piperazin-1-amine
CID 83010396
N-methyl-1-(thiolan-3-yl)methanamine;molecular hydrogen
CID 145167793
N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(thiolan-3-yl)methanamine
CID 107131227
1-cyclohexyl-N-(thiolan-3-ylmethyl)methanamine
CID 107131394
1,1-dimethyl-2-(thiolan-3-ylmethyl)hydrazine
CID 107132348
3-(2,2-dimethylpropyl)thiolane
CID 58797584
(1S)-1-cyclopentyl-N-(thiolan-3-ylmethyl)ethanamine
CID 107132288
2,2-dimethyl-N-(thiolan-3-ylmethyl)propan-1-amine
CID 107131923
3-methyl-N-(thiolan-3-ylmethyl)piperidine-1-carboxamide
CID 107295549
1-cyclohexyl-N-(thiolan-3-ylmethyl)ethanamine
CID 107132041

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine?
The IUPAC name of 4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine (CID 107132351) is 4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine.
What is the SMILES notation for 4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine?
The canonical SMILES for 4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine is CN1CCN(NCC2CCSC2)CC1.
What is the InChIKey of 4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine?
The InChIKey is BMFORIYKZAWXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3S/c1-12-3-5-13(6-4-12)11-8-10-2-7-14-9-10/h10-11H,2-9H2,1H3.
What are the key properties of 4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine?
4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine has a molecular weight of 215.37 g/mol, XLogP of 0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(thiolan-3-ylmethyl)piperazin-1-amine is sourced from PubChem (CID 107132351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).