1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone

C15H19NOS2 — CID 79485722

IUPAC1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone
SMILESCCc1ccc(C(=O)CN(C)CCc2cccs2)s1
InChIInChI=1S/C15H19NOS2/c1-3-12-6-7-15(19-12)14(17)11-16(2)9-8-13-5-4-10-18-13/h4-7,10H,3,8-9,11H2,1-2H3
InChIKeyVQJWEDFHWNYHMC-UHFFFAOYSA-N
MW293.46 g/mol
LogP3.73
Rot. Bonds7

About 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone

1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone (PubChem CID 79485722) has the molecular formula C15H19NOS2 and a molecular weight of 293.46 g/mol. Its IUPAC name is 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone.

Molecular Properties

Compound Name1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone
PubChem CID79485722
Molecular FormulaC15H19NOS2
Molecular Weight293.46 g/mol
Exact Mass293.09
IUPAC Name1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone
SMILESCCc1ccc(C(=O)CN(C)CCc2cccs2)s1
InChIInChI=1S/C15H19NOS2/c1-3-12-6-7-15(19-12)14(17)11-16(2)9-8-13-5-4-10-18-13/h4-7,10H,3,8-9,11H2,1-2H3
InChIKeyVQJWEDFHWNYHMC-UHFFFAOYSA-N
XLogP3.73
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.46
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone with MolForge

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Related Compounds

2-[2-(dimethylamino)ethyl-methylamino]-1-(5-ethylthiophen-2-yl)ethanone
CID 55225801
1-(5-ethylthiophen-2-yl)-2-[methyl(2-pyridin-2-ylethyl)amino]ethanone
CID 43228072
1-(5-ethylthiophen-2-yl)-2-[methyl-[(4-methylphenyl)methyl]amino]ethanone
CID 62051366
1-(3,4-dimethylphenyl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone
CID 79485875
2-[(2-bromophenyl)methyl-methylamino]-1-(5-ethylthiophen-2-yl)ethanone
CID 62036144
1-(2,4-dimethylphenyl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone
CID 79486033
1-(3-methoxyphenyl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone
CID 79486262
2-[methyl(2-thiophen-2-ylethyl)amino]ethanimidamide
CID 79476605
2-[cyclobutylmethyl(methyl)amino]-1-(5-ethylthiophen-2-yl)ethanone
CID 62860809
N-[(5-bromothiophen-2-yl)methyl]-N-methyl-2-thiophen-2-ylethanamine
CID 78989434
1-(5-ethylthiophen-2-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone
CID 114950449
5-[methyl(2-thiophen-2-ylethyl)amino]pentan-2-one
CID 79486633

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone?
The IUPAC name of 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone (CID 79485722) is 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone.
What is the SMILES notation for 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone?
The canonical SMILES for 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone is CCc1ccc(C(=O)CN(C)CCc2cccs2)s1.
What is the InChIKey of 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone?
The InChIKey is VQJWEDFHWNYHMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NOS2/c1-3-12-6-7-15(19-12)14(17)11-16(2)9-8-13-5-4-10-18-13/h4-7,10H,3,8-9,11H2,1-2H3.
What are the key properties of 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone?
1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone has a molecular weight of 293.46 g/mol, XLogP of 3.73, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylthiophen-2-yl)-2-[methyl(2-thiophen-2-ylethyl)amino]ethanone is sourced from PubChem (CID 79485722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).