N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide

C14H16N2OS — CID 43681971

IUPACN,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide
SMILESCN(C)C(=O)c1ccc(NCc2ccsc2)cc1
InChIInChI=1S/C14H16N2OS/c1-16(2)14(17)12-3-5-13(6-4-12)15-9-11-7-8-18-10-11/h3-8,10,15H,9H2,1-2H3
InChIKeyAGXJUQZYJMYKDB-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.06
Rot. Bonds4

About N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide

N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide (PubChem CID 43681971) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide
PubChem CID43681971
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC NameN,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide
SMILESCN(C)C(=O)c1ccc(NCc2ccsc2)cc1
InChIInChI=1S/C14H16N2OS/c1-16(2)14(17)12-3-5-13(6-4-12)15-9-11-7-8-18-10-11/h3-8,10,15H,9H2,1-2H3
InChIKeyAGXJUQZYJMYKDB-UHFFFAOYSA-N
XLogP3.06
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-[4-(thiophen-3-ylmethylamino)phenyl]acetamide
CID 43720754
N-cyclopropyl-4-(thiophen-3-ylmethylamino)benzamide
CID 43687516
4-[(3-bromophenyl)methylamino]-N,N-dimethylbenzamide
CID 43230444
N-benzyl-N-methyl-2-[4-(thiophen-3-ylmethylamino)phenyl]acetamide
CID 42852740
N,N-dimethyl-4-[(4-methyl-1,3-thiazol-2-yl)methylamino]benzamide
CID 115687991
4-[(2,4-dihydroxyphenyl)methylamino]-N,N-dimethylbenzamide
CID 43681979
1-(4-acetylphenyl)-3-(thiophen-3-ylmethyl)urea
CID 60765071
4-(chloromethyl)-N-(thiophen-3-ylmethyl)aniline
CID 65025400
2-[4-(dimethylcarbamoyl)anilino]acetic acid
CID 58044865
4-phenyl-N-(thiophen-3-ylmethyl)aniline
CID 43716853
4-(ethylamino)-N-(2-thiophen-3-ylethyl)benzamide
CID 62173994
4-[(5-cyano-1-methylpyrrol-3-yl)methylamino]-N,N-dimethylbenzamide
CID 103202774

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide?
The IUPAC name of N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide (CID 43681971) is N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide.
What is the SMILES notation for N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide?
The canonical SMILES for N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide is CN(C)C(=O)c1ccc(NCc2ccsc2)cc1.
What is the InChIKey of N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide?
The InChIKey is AGXJUQZYJMYKDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-16(2)14(17)12-3-5-13(6-4-12)15-9-11-7-8-18-10-11/h3-8,10,15H,9H2,1-2H3.
What are the key properties of N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide?
N,N-dimethyl-4-(thiophen-3-ylmethylamino)benzamide has a molecular weight of 260.36 g/mol, XLogP of 3.06, 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-(thiophen-3-ylmethylamino)benzamide is sourced from PubChem (CID 43681971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).