3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide

C14H14N2O3S — CID 68754317

IUPAC3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide
SMILESCOc1ccc(CC(=O)Nc2ccsc2C(N)=O)cc1
InChIInChI=1S/C14H14N2O3S/c1-19-10-4-2-9(3-5-10)8-12(17)16-11-6-7-20-13(11)14(15)18/h2-7H,8H2,1H3,(H2,15,18)(H,16,17)
InChIKeyJZYUWWMHWZDIGX-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.04
Rot. Bonds5

About 3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide

3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide (PubChem CID 68754317) has the molecular formula C14H14N2O3S and a molecular weight of 290.34 g/mol. Its IUPAC name is 3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide.

Molecular Properties

Compound Name3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide
PubChem CID68754317
Molecular FormulaC14H14N2O3S
Molecular Weight290.34 g/mol
Exact Mass290.07
IUPAC Name3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide
SMILESCOc1ccc(CC(=O)Nc2ccsc2C(N)=O)cc1
InChIInChI=1S/C14H14N2O3S/c1-19-10-4-2-9(3-5-10)8-12(17)16-11-6-7-20-13(11)14(15)18/h2-7H,8H2,1H3,(H2,15,18)(H,16,17)
InChIKeyJZYUWWMHWZDIGX-UHFFFAOYSA-N
XLogP2.04
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-2-carboxylate
CID 896829
2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 770967
methyl 3-[(2-pyridin-4-ylacetyl)amino]thiophene-2-carboxylate
CID 43623574
methyl 3-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-2-carboxylate
CID 27805316
5-[[2-(4-methoxyphenyl)acetyl]amino]-2-(methylamino)-1,3-thiazole-4-carboxamide
CID 53039091
N-(2-hydroxy-4-methoxyphenyl)-2-(4-methoxyphenyl)acetamide
CID 154796139
N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(4-methoxyphenyl)acetamide
CID 35540738
methyl 3-[(2-thiophen-3-ylacetyl)amino]thiophene-2-carboxylate
CID 43408027
ethyl N-[2-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-3-carbonyl]carbamate
CID 8719049
N-(2-amino-2-sulfanylideneethyl)-2-(4-methoxyphenyl)acetamide
CID 61127076
2-(4-methoxyphenyl)-N-[2-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]thiophen-3-yl]acetamide
CID 46869740
methyl 3-[(4-methoxyphenyl)methylamino]thiophene-2-carboxylate
CID 59702062

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide?
The IUPAC name of 3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide (CID 68754317) is 3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide.
What is the SMILES notation for 3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide?
The canonical SMILES for 3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide is COc1ccc(CC(=O)Nc2ccsc2C(N)=O)cc1.
What is the InChIKey of 3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide?
The InChIKey is JZYUWWMHWZDIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3S/c1-19-10-4-2-9(3-5-10)8-12(17)16-11-6-7-20-13(11)14(15)18/h2-7H,8H2,1H3,(H2,15,18)(H,16,17).
What are the key properties of 3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide?
3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide has a molecular weight of 290.34 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-2-carboxamide is sourced from PubChem (CID 68754317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).