N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide

C15H16N2O2S — CID 8698592

IUPACN,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide
SMILESCN(C)C(=O)c1ccc(NC(=O)Cc2cccs2)cc1
InChIInChI=1S/C15H16N2O2S/c1-17(2)15(19)11-5-7-12(8-6-11)16-14(18)10-13-4-3-9-20-13/h3-9H,10H2,1-2H3,(H,16,18)
InChIKeyDFIXWAHDKOJBBT-UHFFFAOYSA-N
MW288.37 g/mol
LogP2.63
Rot. Bonds4

About N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide

N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide (PubChem CID 8698592) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide
PubChem CID8698592
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC NameN,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide
SMILESCN(C)C(=O)c1ccc(NC(=O)Cc2cccs2)cc1
InChIInChI=1S/C15H16N2O2S/c1-17(2)15(19)11-5-7-12(8-6-11)16-14(18)10-13-4-3-9-20-13/h3-9H,10H2,1-2H3,(H,16,18)
InChIKeyDFIXWAHDKOJBBT-UHFFFAOYSA-N
XLogP2.63
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 4-[[2-[(2-thiophen-2-ylacetyl)amino]acetyl]amino]benzoate
CID 112999942
N,N'-bis[4-(dimethylcarbamoyl)phenyl]propanediamide
CID 17368155
2-thiophen-2-yl-N-[4-[[4-[(2-thiophen-2-ylacetyl)amino]phenyl]disulfanyl]phenyl]acetamide
CID 3108904
N-[4-[3-(dimethylamino)propylamino]phenyl]-2-thiophen-2-ylacetamide
CID 112981528
N-[4-(4-methylphenoxy)phenyl]-2-thiophen-2-ylacetamide
CID 7925201
N-[4-(prop-2-enylcarbamoylamino)phenyl]-2-thiophen-2-ylacetamide
CID 38019423
N-[4-(2-methoxyethoxy)phenyl]-2-thiophen-2-ylacetamide
CID 47183041
4-[[2-(4-fluorophenyl)acetyl]amino]-N,N-dimethylbenzamide
CID 8698667
2-thiophen-2-yl-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2808201
N-[2-oxo-2-(4-propan-2-ylanilino)ethyl]-2-thiophen-2-ylacetamide
CID 112997181
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-thiophen-2-ylacetamide
CID 7744758
2-thiophen-2-yl-N-[2-[(2-thiophen-2-ylacetyl)amino]ethyl]acetamide
CID 25146649

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide?
The IUPAC name of N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide (CID 8698592) is N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide?
The canonical SMILES for N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide is CN(C)C(=O)c1ccc(NC(=O)Cc2cccs2)cc1.
What is the InChIKey of N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide?
The InChIKey is DFIXWAHDKOJBBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c1-17(2)15(19)11-5-7-12(8-6-11)16-14(18)10-13-4-3-9-20-13/h3-9H,10H2,1-2H3,(H,16,18).
What are the key properties of N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide?
N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide has a molecular weight of 288.37 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(2-thiophen-2-ylacetyl)amino]benzamide is sourced from PubChem (CID 8698592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).