2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine

C10H21NOS — CID 57227058

IUPAC2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine
SMILESCCNC(COCC)C1CCSC1
InChIInChI=1S/C10H21NOS/c1-3-11-10(7-12-4-2)9-5-6-13-8-9/h9-11H,3-8H2,1-2H3
InChIKeyYSIKSPYYBHSWDL-UHFFFAOYSA-N
MW203.35 g/mol
LogP1.75
Rot. Bonds6

About 2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine

2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine (PubChem CID 57227058) has the molecular formula C10H21NOS and a molecular weight of 203.35 g/mol. Its IUPAC name is 2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine
PubChem CID57227058
Molecular FormulaC10H21NOS
Molecular Weight203.35 g/mol
Exact Mass203.13
IUPAC Name2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine
SMILESCCNC(COCC)C1CCSC1
InChIInChI=1S/C10H21NOS/c1-3-11-10(7-12-4-2)9-5-6-13-8-9/h9-11H,3-8H2,1-2H3
InChIKeyYSIKSPYYBHSWDL-UHFFFAOYSA-N
XLogP1.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.35
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Fluoro pyrrolidine-2-carboxaldehyde diethylthioacetal
CID 18439648
N-ethyl-4-[2-(2,2,2-trifluoroethoxy)ethyl]thiolan-3-amine
CID 83195570
N-methyl-4-[2-(2,2,2-trifluoroethoxy)ethyl]thiolan-3-amine
CID 83196188
N-propyl-4-[2-(2,2,2-trifluoroethoxy)ethyl]thiolan-3-amine
CID 83196729
[(3-Thienyl)methyl](2-methoxyethyl)amine
CID 64166447
(2S)-2-[ethoxy(ethylsulfanyl)methyl]pyrrolidine
CID 53736408
2-[Ethoxy(ethylsulfanyl)methyl]pyrrolidine
CID 53736409
6-Ethyl-9-oxa-1-thia-4-azaspiro[4.5]decane
CID 122597275
N-(2-ethoxyethyl)thiolan-3-amine
CID 43590766
N-(2-butoxyethyl)thiolan-3-amine
CID 61171821
4-Methyl-2-[(thiolan-3-yl)amino]pentan-1-ol
CID 61242208
N-(1-ethoxypropan-2-yl)thiolan-3-amine
CID 61822656

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine?
The IUPAC name of 2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine (CID 57227058) is 2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine.
What is the SMILES notation for 2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine?
The canonical SMILES for 2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine is CCNC(COCC)C1CCSC1.
What is the InChIKey of 2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine?
The InChIKey is YSIKSPYYBHSWDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NOS/c1-3-11-10(7-12-4-2)9-5-6-13-8-9/h9-11H,3-8H2,1-2H3.
What are the key properties of 2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine?
2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine has a molecular weight of 203.35 g/mol, XLogP of 1.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-ethyl-1-(thiolan-3-yl)ethanamine is sourced from PubChem (CID 57227058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).