2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine

C14H23NOS — CID 115842333

IUPAC2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine
SMILESCCc1ccc(CC(NC)C2CCC(C)O2)s1
InChIInChI=1S/C14H23NOS/c1-4-11-6-7-12(17-11)9-13(15-3)14-8-5-10(2)16-14/h6-7,10,13-15H,4-5,8-9H2,1-3H3
InChIKeyJFUQQYNSLQJQSD-UHFFFAOYSA-N
MW253.41 g/mol
LogP3.01
Rot. Bonds5

About 2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine

2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine (PubChem CID 115842333) has the molecular formula C14H23NOS and a molecular weight of 253.41 g/mol. Its IUPAC name is 2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine
PubChem CID115842333
Molecular FormulaC14H23NOS
Molecular Weight253.41 g/mol
Exact Mass253.15
IUPAC Name2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine
SMILESCCc1ccc(CC(NC)C2CCC(C)O2)s1
InChIInChI=1S/C14H23NOS/c1-4-11-6-7-12(17-11)9-13(15-3)14-8-5-10(2)16-14/h6-7,10,13-15H,4-5,8-9H2,1-3H3
InChIKeyJFUQQYNSLQJQSD-UHFFFAOYSA-N
XLogP3.01
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.41
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-chlorothiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine
CID 115841409
2-(5-ethylthiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
CID 65422780
N-methyl-1-(5-methyloxolan-2-yl)-2-thiophen-3-ylethanamine
CID 115845115
1-(4,4-dimethylcyclohexyl)-2-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 65391425
(5-ethylthiophen-2-yl)-(5-methyloxolan-2-yl)methanol
CID 81330791
2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 65425118
2-(3,4-dichlorophenyl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine
CID 115843383
2-(3-fluorophenyl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine
CID 115795534
N-ethyl-1-(5-methyloxolan-2-yl)-2-thiophen-2-ylethanamine
CID 115840777
N-methyl-1-(5-methyloxolan-2-yl)hexan-1-amine
CID 115837035
N-[1-cyclopropyl-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 62600030
N-[1-cyclohexyl-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 63413397

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine?
The IUPAC name of 2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine (CID 115842333) is 2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine.
What is the SMILES notation for 2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine?
The canonical SMILES for 2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine is CCc1ccc(CC(NC)C2CCC(C)O2)s1.
What is the InChIKey of 2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine?
The InChIKey is JFUQQYNSLQJQSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NOS/c1-4-11-6-7-12(17-11)9-13(15-3)14-8-5-10(2)16-14/h6-7,10,13-15H,4-5,8-9H2,1-3H3.
What are the key properties of 2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine?
2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine has a molecular weight of 253.41 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)ethanamine is sourced from PubChem (CID 115842333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).