2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide

C15H18N2OS — CID 79195857

IUPAC2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide
SMILESCNCC(C)C(=O)Nc1ccccc1-c1cccs1
InChIInChI=1S/C15H18N2OS/c1-11(10-16-2)15(18)17-13-7-4-3-6-12(13)14-8-5-9-19-14/h3-9,11,16H,10H2,1-2H3,(H,17,18)
InChIKeyNRQTZFXWXKDKDH-UHFFFAOYSA-N
MW274.39 g/mol
LogP3.21
Rot. Bonds5

About 2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide

2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide (PubChem CID 79195857) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide.

Molecular Properties

Compound Name2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide
PubChem CID79195857
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC Name2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide
SMILESCNCC(C)C(=O)Nc1ccccc1-c1cccs1
InChIInChI=1S/C15H18N2OS/c1-11(10-16-2)15(18)17-13-7-4-3-6-12(13)14-8-5-9-19-14/h3-9,11,16H,10H2,1-2H3,(H,17,18)
InChIKeyNRQTZFXWXKDKDH-UHFFFAOYSA-N
XLogP3.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-(methylamino)-N-(3-thiophen-2-ylphenyl)propanamide
CID 119708574
3-methyl-5-oxo-5-(2-thiophen-2-ylanilino)pentanoic acid
CID 62966107
2-(4-methoxyphenoxy)-N-(2-thiophen-2-ylphenyl)propanamide
CID 51327828
(2S)-2-(4-bromophenoxy)-N-(2-thiophen-2-ylphenyl)propanamide
CID 51535760
2-methyl-3-(methylamino)-N-(2-methylsulfanylphenyl)propanamide
CID 79196419
2-(2-thiophen-2-ylanilino)propanoic acid
CID 66173526
1-(3-hydroxypropyl)-3-(2-thiophen-2-ylphenyl)urea
CID 110891086
2-methyl-3-(methylamino)-N-(2-methylsulfanylphenyl)propanamide;hydrochloride
CID 119674747
N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide
CID 17412743
3-(tert-butylamino)-N-(2-thiophen-2-ylphenyl)propanamide
CID 60850106
N-[2-(methanesulfonamido)phenyl]-2-methyl-3-(methylamino)propanamide
CID 79195522
2-(1,3-dioxoisoindol-2-yl)-N-(2-thiophen-2-ylphenyl)acetamide
CID 51286975

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide?
The IUPAC name of 2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide (CID 79195857) is 2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide.
What is the SMILES notation for 2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide?
The canonical SMILES for 2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide is CNCC(C)C(=O)Nc1ccccc1-c1cccs1.
What is the InChIKey of 2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide?
The InChIKey is NRQTZFXWXKDKDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c1-11(10-16-2)15(18)17-13-7-4-3-6-12(13)14-8-5-9-19-14/h3-9,11,16H,10H2,1-2H3,(H,17,18).
What are the key properties of 2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide?
2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide has a molecular weight of 274.39 g/mol, XLogP of 3.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylamino)-N-(2-thiophen-2-ylphenyl)propanamide is sourced from PubChem (CID 79195857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).