N-(thiomorpholin-3-ylmethyl)ethanamine

C7H16N2S — CID 82916840

IUPACN-(thiomorpholin-3-ylmethyl)ethanamine
SMILESCCNCC1CSCCN1
InChIInChI=1S/C7H16N2S/c1-2-8-5-7-6-10-4-3-9-7/h7-9H,2-6H2,1H3
InChIKeyFTRFMHYUIXMQIA-UHFFFAOYSA-N
MW160.29 g/mol
LogP0.30
Rot. Bonds3

About N-(thiomorpholin-3-ylmethyl)ethanamine

N-(thiomorpholin-3-ylmethyl)ethanamine (PubChem CID 82916840) has the molecular formula C7H16N2S and a molecular weight of 160.29 g/mol. Its IUPAC name is N-(thiomorpholin-3-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-(thiomorpholin-3-ylmethyl)ethanamine
PubChem CID82916840
Molecular FormulaC7H16N2S
Molecular Weight160.29 g/mol
Exact Mass160.10
IUPAC NameN-(thiomorpholin-3-ylmethyl)ethanamine
SMILESCCNCC1CSCCN1
InChIInChI=1S/C7H16N2S/c1-2-8-5-7-6-10-4-3-9-7/h7-9H,2-6H2,1H3
InChIKeyFTRFMHYUIXMQIA-UHFFFAOYSA-N
XLogP0.30
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.29
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(thiomorpholin-3-ylmethyl)thiomorpholine
CID 68605296
N-(2-thiomorpholin-3-ylethyl)butan-1-amine
CID 66422325
N-(2,2-diethylbutyl)-2-thiomorpholin-3-ylacetamide
CID 119940576
3-(bromomethyl)thiomorpholine
CID 119096156
N-(piperidin-2-ylmethyl)ethanamine
CID 11970483
2,2-dimethyl-N-(2-thiomorpholin-3-ylethyl)butan-1-amine
CID 103462147
2-(1,3-thiazol-4-yl)-N-(thiomorpholin-3-ylmethyl)ethanamine
CID 82916054
N-(2-thiomorpholin-3-ylethyl)butan-2-amine
CID 66421926
N-(2-methoxyethyl)-2-thiomorpholin-3-ylethanamine
CID 66420350
N-(2,2-dimethylpropyl)-2-thiomorpholin-3-ylacetamide
CID 66422271
N-(2-hydroxy-2-methylbutyl)-2-thiomorpholin-3-ylacetamide
CID 66421910
N-(1-hydroxybutan-2-yl)-2-thiomorpholin-3-ylacetamide
CID 66422411

Frequently Asked Questions

What is the IUPAC name of N-(thiomorpholin-3-ylmethyl)ethanamine?
The IUPAC name of N-(thiomorpholin-3-ylmethyl)ethanamine (CID 82916840) is N-(thiomorpholin-3-ylmethyl)ethanamine.
What is the SMILES notation for N-(thiomorpholin-3-ylmethyl)ethanamine?
The canonical SMILES for N-(thiomorpholin-3-ylmethyl)ethanamine is CCNCC1CSCCN1.
What is the InChIKey of N-(thiomorpholin-3-ylmethyl)ethanamine?
The InChIKey is FTRFMHYUIXMQIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2S/c1-2-8-5-7-6-10-4-3-9-7/h7-9H,2-6H2,1H3.
What are the key properties of N-(thiomorpholin-3-ylmethyl)ethanamine?
N-(thiomorpholin-3-ylmethyl)ethanamine has a molecular weight of 160.29 g/mol, XLogP of 0.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiomorpholin-3-ylmethyl)ethanamine is sourced from PubChem (CID 82916840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).