2-amino-N-(2-benzoylthiophen-3-yl)acetamide

C13H12N2O2S — CID 16639900

IUPAC2-amino-N-(2-benzoylthiophen-3-yl)acetamide
SMILESNCC(=O)Nc1ccsc1C(=O)c1ccccc1
InChIInChI=1S/C13H12N2O2S/c14-8-11(16)15-10-6-7-18-13(10)12(17)9-4-2-1-3-5-9/h1-7H,8,14H2,(H,15,16)
InChIKeyGIAYOLDHWYWNCP-UHFFFAOYSA-N
MW260.32 g/mol
LogP1.88
Rot. Bonds4

About 2-amino-N-(2-benzoylthiophen-3-yl)acetamide

2-amino-N-(2-benzoylthiophen-3-yl)acetamide (PubChem CID 16639900) has the molecular formula C13H12N2O2S and a molecular weight of 260.32 g/mol. Its IUPAC name is 2-amino-N-(2-benzoylthiophen-3-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(2-benzoylthiophen-3-yl)acetamide
PubChem CID16639900
Molecular FormulaC13H12N2O2S
Molecular Weight260.32 g/mol
Exact Mass260.06
IUPAC Name2-amino-N-(2-benzoylthiophen-3-yl)acetamide
SMILESNCC(=O)Nc1ccsc1C(=O)c1ccccc1
InChIInChI=1S/C13H12N2O2S/c14-8-11(16)15-10-6-7-18-13(10)12(17)9-4-2-1-3-5-9/h1-7H,8,14H2,(H,15,16)
InChIKeyGIAYOLDHWYWNCP-UHFFFAOYSA-N
XLogP1.88
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-benzoylthiophen-3-yl)-3-oxopropanoic acid
CID 19785051
2-(2-benzoylthiophen-3-yl)oxy-N-(2-methylphenyl)acetamide
CID 11703068
(2-benzoylthiophen-3-yl)methyl acetate
CID 134109322
3-[[2-[aminomethyl(ethyl)amino]acetyl]amino]thiophene-2-carboxylic acid;ethane
CID 142231720
3-[3-(2-methylphenyl)propanoylamino]thiophene-2-carboxylic acid
CID 62367247
methyl 3-(3,3-diphenylpropanoylamino)thiophene-2-carboxylate
CID 3421520
2-amino-N-(2-chlorophenyl)acetamide;hydrochloride
CID 51051964
3-(3-methylsulfonylpropanoylamino)thiophene-2-carboxylic acid
CID 43358015
methyl (E)-3-[2-[(2-aminoacetyl)amino]phenyl]prop-2-enoate
CID 70253716
3-[(3-hydroxybenzoyl)amino]thiophene-2-carboxylic acid
CID 16773315
2-amino-N-[2-[(dimethylamino)methyl]phenyl]acetamide
CID 43695681
3-benzoylthiophene-2-carboxylate
CID 6995645

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-benzoylthiophen-3-yl)acetamide?
The IUPAC name of 2-amino-N-(2-benzoylthiophen-3-yl)acetamide (CID 16639900) is 2-amino-N-(2-benzoylthiophen-3-yl)acetamide.
What is the SMILES notation for 2-amino-N-(2-benzoylthiophen-3-yl)acetamide?
The canonical SMILES for 2-amino-N-(2-benzoylthiophen-3-yl)acetamide is NCC(=O)Nc1ccsc1C(=O)c1ccccc1.
What is the InChIKey of 2-amino-N-(2-benzoylthiophen-3-yl)acetamide?
The InChIKey is GIAYOLDHWYWNCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2S/c14-8-11(16)15-10-6-7-18-13(10)12(17)9-4-2-1-3-5-9/h1-7H,8,14H2,(H,15,16).
What are the key properties of 2-amino-N-(2-benzoylthiophen-3-yl)acetamide?
2-amino-N-(2-benzoylthiophen-3-yl)acetamide has a molecular weight of 260.32 g/mol, XLogP of 1.88, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-benzoylthiophen-3-yl)acetamide is sourced from PubChem (CID 16639900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).