N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide

C12H20N2OS — CID 79201660

IUPACN-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide
SMILESCCN(Cc1cccs1)C(=O)C(C)CNC
InChIInChI=1S/C12H20N2OS/c1-4-14(9-11-6-5-7-16-11)12(15)10(2)8-13-3/h5-7,10,13H,4,8-9H2,1-3H3
InChIKeyADKZVZFYMGOKOI-UHFFFAOYSA-N
MW240.37 g/mol
LogP1.95
Rot. Bonds6

About N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide

N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide (PubChem CID 79201660) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide.

Molecular Properties

Compound NameN-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide
PubChem CID79201660
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC NameN-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide
SMILESCCN(Cc1cccs1)C(=O)C(C)CNC
InChIInChI=1S/C12H20N2OS/c1-4-14(9-11-6-5-7-16-11)12(15)10(2)8-13-3/h5-7,10,13H,4,8-9H2,1-3H3
InChIKeyADKZVZFYMGOKOI-UHFFFAOYSA-N
XLogP1.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methoxyphenyl)methyl]-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
CID 119685033
2-N-ethyl-1-N-methyl-2-N-(thiophen-2-ylmethyl)propane-1,2-diamine
CID 62463283
N,2-dimethyl-3-(methylamino)-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride
CID 119807079
N-[(5-bromothiophen-2-yl)methyl]-N-ethyl-2-methyl-3-(methylamino)propanamide
CID 79195708
N-ethyl-2-methyl-3-(2-methylphenyl)-N-(thiophen-2-ylmethyl)propanamide
CID 138547765
2-amino-N-ethyl-3-methyl-N-(thiophen-2-ylmethyl)butanamide;hydrochloride
CID 119271522
2-(aminomethyl)-N-ethyl-3-methyl-N-(thiophen-2-ylmethyl)butanamide
CID 65230128
N-[1-[ethyl(thiophen-2-ylmethyl)amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide
CID 134019558
N-ethyl-2,2-diphenyl-N-(thiophen-2-ylmethyl)acetamide
CID 134014388
3-amino-N-ethyl-2-methyl-3-phenyl-N-(thiophen-2-ylmethyl)propanamide
CID 75468778
N-[(3-chlorophenyl)methyl]-N-ethyl-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119722995
N-ethyl-N-[(3-fluorophenyl)methyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119690197

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide?
The IUPAC name of N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide (CID 79201660) is N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide.
What is the SMILES notation for N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide?
The canonical SMILES for N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide is CCN(Cc1cccs1)C(=O)C(C)CNC.
What is the InChIKey of N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide?
The InChIKey is ADKZVZFYMGOKOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-4-14(9-11-6-5-7-16-11)12(15)10(2)8-13-3/h5-7,10,13H,4,8-9H2,1-3H3.
What are the key properties of N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide?
N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide has a molecular weight of 240.37 g/mol, XLogP of 1.95, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-3-(methylamino)-N-(thiophen-2-ylmethyl)propanamide is sourced from PubChem (CID 79201660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).