N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine

C10H21NOS — CID 105165560

IUPACN-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine
SMILESCCNC(COC)C1(C)CCCS1
InChIInChI=1S/C10H21NOS/c1-4-11-9(8-12-3)10(2)6-5-7-13-10/h9,11H,4-8H2,1-3H3
InChIKeyUJBOLEXROOINRL-UHFFFAOYSA-N
MW203.35 g/mol
LogP1.90
Rot. Bonds5

About N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine

N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine (PubChem CID 105165560) has the molecular formula C10H21NOS and a molecular weight of 203.35 g/mol. Its IUPAC name is N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine
PubChem CID105165560
Molecular FormulaC10H21NOS
Molecular Weight203.35 g/mol
Exact Mass203.13
IUPAC NameN-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine
SMILESCCNC(COC)C1(C)CCCS1
InChIInChI=1S/C10H21NOS/c1-4-11-9(8-12-3)10(2)6-5-7-13-10/h9,11H,4-8H2,1-3H3
InChIKeyUJBOLEXROOINRL-UHFFFAOYSA-N
XLogP1.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.35
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4-methyl-1-(2-methylthiolan-2-yl)pent-4-en-1-amine
CID 105182489
N-ethyl-1-(2-methylthiolan-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 105147773
1-[1-(ethylamino)-2-methoxyethyl]-N,N-dimethylcyclopentan-1-amine
CID 79568577
N-methyl-1-(2-methylthiolan-2-yl)hexan-1-amine
CID 105129851
N-[2-cyclopropyl-1-(2-methylthiolan-2-yl)ethyl]propan-1-amine
CID 105152948
2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-N-ethyl-1-(2-methylthiolan-2-yl)ethanamine
CID 105159661
N-[[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]-(2-methylthiolan-2-yl)methyl]ethanamine
CID 105184226
N-[(4-methoxy-2,5-dimethylphenyl)-(2-methylthiolan-2-yl)methyl]ethanamine
CID 105179032
N-methyl-3-methylidene-1-(2-methylthiolan-2-yl)pentan-1-amine
CID 105164036
N-methyl-1-(2-methylthiolan-2-yl)but-3-yn-1-amine
CID 105077554
N-ethyl-2-(1-methylindazol-3-yl)-1-(2-methylthiolan-2-yl)ethanamine
CID 105161379
N-[(4-chloro-3-methoxyphenyl)-(2-methylthiolan-2-yl)methyl]ethanamine
CID 105164486

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine?
The IUPAC name of N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine (CID 105165560) is N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine?
The canonical SMILES for N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine is CCNC(COC)C1(C)CCCS1.
What is the InChIKey of N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine?
The InChIKey is UJBOLEXROOINRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NOS/c1-4-11-9(8-12-3)10(2)6-5-7-13-10/h9,11H,4-8H2,1-3H3.
What are the key properties of N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine?
N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine has a molecular weight of 203.35 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-1-(2-methylthiolan-2-yl)ethanamine is sourced from PubChem (CID 105165560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).