N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide

C11H16N2O2S — CID 106916547

IUPACN-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide
SMILESCNC(=O)CCN(C)CC(=O)c1cccs1
InChIInChI=1S/C11H16N2O2S/c1-12-11(15)5-6-13(2)8-9(14)10-4-3-7-16-10/h3-4,7H,5-6,8H2,1-2H3,(H,12,15)
InChIKeyCKZOOIDMSLZYSO-UHFFFAOYSA-N
MW240.33 g/mol
LogP1.00
Rot. Bonds6

About N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide

N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide (PubChem CID 106916547) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide.

Molecular Properties

Compound NameN-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide
PubChem CID106916547
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC NameN-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide
SMILESCNC(=O)CCN(C)CC(=O)c1cccs1
InChIInChI=1S/C11H16N2O2S/c1-12-11(15)5-6-13(2)8-9(14)10-4-3-7-16-10/h3-4,7H,5-6,8H2,1-2H3,(H,12,15)
InChIKeyCKZOOIDMSLZYSO-UHFFFAOYSA-N
XLogP1.00
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethyl-(2-oxo-2-thiophen-2-ylethyl)amino]-N-methylacetamide
CID 62052835
2-[methyl(2-methylpropyl)amino]-1-thiophen-2-ylethanone
CID 43795696
3-[hydroxy(methyl)amino]-1-thiophen-2-ylpropan-1-one;methanol;N-methylhydroxylamine;1-thiophen-2-ylethanone
CID 158976302
2-[methyl-[(3-methylphenyl)methyl]amino]-1-thiophen-2-ylethanone
CID 62030952
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]-1-thiophen-2-ylethanone
CID 62037588
N'-[2-[(3-amino-4-methylpentyl)-methylamino]acetyl]thiophene-2-carbohydrazide
CID 115317749
1-thiophen-2-ylpropan-1-one
CID 26179
2-amino-N-methyl-N-(2-oxo-2-thiophen-2-ylethyl)propanamide
CID 77144663
1-thiophen-2-ylpentane-1,4-dione
CID 2741853
N,N-diethyl-3-oxo-3-thiophen-2-ylpropanamide
CID 22925217
2-[1-methoxypropan-2-yl(methyl)amino]-1-thiophen-2-ylethanone
CID 61451901
2-[methyl(piperidin-4-yl)amino]-1-thiophen-2-ylethanone
CID 62030561

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide?
The IUPAC name of N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide (CID 106916547) is N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide.
What is the SMILES notation for N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide?
The canonical SMILES for N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide is CNC(=O)CCN(C)CC(=O)c1cccs1.
What is the InChIKey of N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide?
The InChIKey is CKZOOIDMSLZYSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-12-11(15)5-6-13(2)8-9(14)10-4-3-7-16-10/h3-4,7H,5-6,8H2,1-2H3,(H,12,15).
What are the key properties of N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide?
N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide has a molecular weight of 240.33 g/mol, XLogP of 1.00, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[methyl-(2-oxo-2-thiophen-2-ylethyl)amino]propanamide is sourced from PubChem (CID 106916547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).