2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine

C10H20N2OS — CID 82836499

IUPAC2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine
SMILESNCC(C1CCCO1)N1CCSCC1
InChIInChI=1S/C10H20N2OS/c11-8-9(10-2-1-5-13-10)12-3-6-14-7-4-12/h9-10H,1-8,11H2
InChIKeyJNWLXIICVOIIFJ-UHFFFAOYSA-N
MW216.35 g/mol
LogP0.54
Rot. Bonds3

About 2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine

2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine (PubChem CID 82836499) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is 2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine.

Molecular Properties

Compound Name2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine
PubChem CID82836499
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC Name2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine
SMILESNCC(C1CCCO1)N1CCSCC1
InChIInChI=1S/C10H20N2OS/c11-8-9(10-2-1-5-13-10)12-3-6-14-7-4-12/h9-10H,1-8,11H2
InChIKeyJNWLXIICVOIIFJ-UHFFFAOYSA-N
XLogP0.54
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine
CID 82835130
2-(oxolan-2-yl)-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanamine
CID 82835820
2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-(oxolan-2-yl)ethanamine
CID 82835938
2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(oxolan-2-yl)ethanamine
CID 82839506
2-(oxolan-2-yl)-2-(2,2,6-trimethylmorpholin-4-yl)ethanamine
CID 82835815
2-(4-tert-butylcyclohexyl)-2-(1,4-thiazepan-4-yl)ethanamine
CID 104575373
2-(2,5-dimethylmorpholin-4-yl)-2-(oxolan-2-yl)ethanamine
CID 82836404
1-(oxolan-2-yl)-N-propan-2-ylethane-1,2-diamine
CID 82835407
[1-[1-(oxolan-2-yl)ethyl]pyrrolidin-2-yl]methanamine
CID 130577654
2-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl)-2-(thiolan-3-yl)ethanamine
CID 107132688
2-methyl-3-thiomorpholin-4-ylbutan-1-amine
CID 79414847
2-cyclopentyl-2-(2-methyl-1,4-oxazepan-4-yl)ethanamine
CID 62988805

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine?
The IUPAC name of 2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine (CID 82836499) is 2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine.
What is the SMILES notation for 2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine?
The canonical SMILES for 2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine is NCC(C1CCCO1)N1CCSCC1.
What is the InChIKey of 2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine?
The InChIKey is JNWLXIICVOIIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS/c11-8-9(10-2-1-5-13-10)12-3-6-14-7-4-12/h9-10H,1-8,11H2.
What are the key properties of 2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine?
2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine has a molecular weight of 216.35 g/mol, XLogP of 0.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine is sourced from PubChem (CID 82836499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).