1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine

C16H21NOS — CID 116773547

IUPAC1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine
SMILESCCOC(c1ccccc1)C(Cc1cccs1)NC
InChIInChI=1S/C16H21NOS/c1-3-18-16(13-8-5-4-6-9-13)15(17-2)12-14-10-7-11-19-14/h4-11,15-17H,3,12H2,1-2H3
InChIKeyRSCFVPBSQPXKII-UHFFFAOYSA-N
MW275.42 g/mol
LogP3.66
Rot. Bonds7

About 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine

1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine (PubChem CID 116773547) has the molecular formula C16H21NOS and a molecular weight of 275.42 g/mol. Its IUPAC name is 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine.

Molecular Properties

Compound Name1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine
PubChem CID116773547
Molecular FormulaC16H21NOS
Molecular Weight275.42 g/mol
Exact Mass275.13
IUPAC Name1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine
SMILESCCOC(c1ccccc1)C(Cc1cccs1)NC
InChIInChI=1S/C16H21NOS/c1-3-18-16(13-8-5-4-6-9-13)15(17-2)12-14-10-7-11-19-14/h4-11,15-17H,3,12H2,1-2H3
InChIKeyRSCFVPBSQPXKII-UHFFFAOYSA-N
XLogP3.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine 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,3-dimethyl-1-thiophen-2-ylhexan-2-amine
CID 61064795
1-ethoxy-N-ethyl-1-phenyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 116773805
1-ethoxy-N-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpropan-2-amine
CID 116773579
1-ethoxy-1-phenyl-N-propyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 116773875
[3-(5-chlorothiophen-2-yl)-1-ethoxy-1-phenylpropan-2-yl]hydrazine
CID 105279353
(1-ethoxy-1-phenyl-3-propan-2-yloxypropan-2-yl)hydrazine
CID 105279365
1-methoxy-1-phenyl-N-propyl-4-thiophen-2-ylbutan-2-amine
CID 116773230
(3-cyclopropyl-1-ethoxy-1-phenylpropan-2-yl)hydrazine
CID 105279201
N,N'-dimethyl-1-phenyl-N-(1-thiophen-2-ylpropan-2-yl)ethane-1,2-diamine
CID 79493768
3-phenyl-1-thiophen-2-ylpentan-2-ol
CID 115785629
1-phenyl-1-(2-thiophen-2-ylethoxy)propan-2-amine
CID 55017191
[(1S,2S)-1-ethoxy-2-methoxy-2-phenylethyl]benzene
CID 143834566

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine?
The IUPAC name of 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine (CID 116773547) is 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine.
What is the SMILES notation for 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine?
The canonical SMILES for 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine is CCOC(c1ccccc1)C(Cc1cccs1)NC.
What is the InChIKey of 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine?
The InChIKey is RSCFVPBSQPXKII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NOS/c1-3-18-16(13-8-5-4-6-9-13)15(17-2)12-14-10-7-11-19-14/h4-11,15-17H,3,12H2,1-2H3.
What are the key properties of 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine?
1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine has a molecular weight of 275.42 g/mol, XLogP of 3.66, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-methyl-1-phenyl-3-thiophen-2-ylpropan-2-amine is sourced from PubChem (CID 116773547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).