N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine

C13H23NOS — CID 105013350

IUPACN-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine
SMILESCCNC(COC(C)C)c1sccc1CC
InChIInChI=1S/C13H23NOS/c1-5-11-7-8-16-13(11)12(14-6-2)9-15-10(3)4/h7-8,10,12,14H,5-6,9H2,1-4H3
InChIKeyASAWUZATKNJUIN-UHFFFAOYSA-N
MW241.40 g/mol
LogP3.39
Rot. Bonds7

About N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine

N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine (PubChem CID 105013350) has the molecular formula C13H23NOS and a molecular weight of 241.40 g/mol. Its IUPAC name is N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine.

Molecular Properties

Compound NameN-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine
PubChem CID105013350
Molecular FormulaC13H23NOS
Molecular Weight241.40 g/mol
Exact Mass241.15
IUPAC NameN-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine
SMILESCCNC(COC(C)C)c1sccc1CC
InChIInChI=1S/C13H23NOS/c1-5-11-7-8-16-13(11)12(14-6-2)9-15-10(3)4/h7-8,10,12,14H,5-6,9H2,1-4H3
InChIKeyASAWUZATKNJUIN-UHFFFAOYSA-N
XLogP3.39
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.40
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-1-(3-ethylthiophen-2-yl)propan-1-amine
CID 114979794
N-[(3-ethylthiophen-2-yl)-(4-propan-2-yloxyphenyl)methyl]ethanamine
CID 79972709
2-(2,5-dimethylphenyl)-N-ethyl-1-(3-ethylthiophen-2-yl)ethanamine
CID 79976365
1-(3-ethylthiophen-2-yl)-N,3-dimethylbutan-1-amine
CID 115782273
N-ethyl-1-(3-ethylthiophen-2-yl)-2-methylpentan-1-amine
CID 107893684
N-ethyl-1-(3-ethylthiophen-2-yl)-2-(2-propan-2-yl-1,2,4-triazol-3-yl)ethanamine
CID 104999726
N-ethyl-1-(3-ethylthiophen-2-yl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103029901
ethane;3-ethyl-2-propan-2-ylthiophene
CID 153374658
2-(2-chloro-4-methylphenyl)-N-ethyl-1-(3-ethylthiophen-2-yl)ethanamine
CID 106867922
N-ethyl-1-(3-ethylthiophen-2-yl)-2-(2-propyl-1,2,4-triazol-3-yl)ethanamine
CID 105003199
1-(3-chlorothiophen-2-yl)-N-methyl-2-propan-2-yloxyethanamine
CID 105013001
N-[2-cyclopropyl-1-(3-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 104986473

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine?
The IUPAC name of N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine (CID 105013350) is N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine.
What is the SMILES notation for N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine?
The canonical SMILES for N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine is CCNC(COC(C)C)c1sccc1CC.
What is the InChIKey of N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine?
The InChIKey is ASAWUZATKNJUIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NOS/c1-5-11-7-8-16-13(11)12(14-6-2)9-15-10(3)4/h7-8,10,12,14H,5-6,9H2,1-4H3.
What are the key properties of N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine?
N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine has a molecular weight of 241.40 g/mol, XLogP of 3.39, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-ethylthiophen-2-yl)-2-propan-2-yloxyethanamine is sourced from PubChem (CID 105013350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).