3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide

C13H14N2OS — CID 61091897

IUPAC3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide
SMILESCCc1ccccc1NC(=O)c1sccc1N
InChIInChI=1S/C13H14N2OS/c1-2-9-5-3-4-6-11(9)15-13(16)12-10(14)7-8-17-12/h3-8H,2,14H2,1H3,(H,15,16)
InChIKeyXOJRQCXRGHNKAZ-UHFFFAOYSA-N
MW246.34 g/mol
LogP3.14
Rot. Bonds3

About 3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide

3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide (PubChem CID 61091897) has the molecular formula C13H14N2OS and a molecular weight of 246.34 g/mol. Its IUPAC name is 3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide
PubChem CID61091897
Molecular FormulaC13H14N2OS
Molecular Weight246.34 g/mol
Exact Mass246.08
IUPAC Name3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide
SMILESCCc1ccccc1NC(=O)c1sccc1N
InChIInChI=1S/C13H14N2OS/c1-2-9-5-3-4-6-11(9)15-13(16)12-10(14)7-8-17-12/h3-8H,2,14H2,1H3,(H,15,16)
InChIKeyXOJRQCXRGHNKAZ-UHFFFAOYSA-N
XLogP3.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.34
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide
CID 8839481
3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide
CID 61091035
N-[2-(aminomethyl)phenyl]-3-methylthiophene-2-carboxamide
CID 64894662
3-amino-N-(4-ethylphenyl)thiophene-2-carboxamide
CID 61089660
N-[2-(chloromethyl)phenyl]-3-methylthiophene-2-carboxamide
CID 114298265
N-[2-(2-aminoethylcarbamoyl)phenyl]-3-ethylthiophene-2-carboxamide
CID 120604147
1-N,2-N-bis(2-ethylphenyl)benzene-1,2-dicarboxamide
CID 4151337
N-(2-aminophenyl)-3-methoxythiophene-2-carboxamide
CID 81116979
N-(2-ethylphenyl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 9047021
3-methyl-N-[2-(methylsulfinylmethyl)phenyl]thiophene-2-carboxamide
CID 86815311
1-amino-N-(2-ethylphenyl)cyclopropane-1-carboxamide
CID 65465258
2-amino-N-(2-ethylphenyl)-1,3-thiazole-5-carboxamide
CID 141271026

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide (CID 61091897) is 3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide is CCc1ccccc1NC(=O)c1sccc1N.
What is the InChIKey of 3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide?
The InChIKey is XOJRQCXRGHNKAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2OS/c1-2-9-5-3-4-6-11(9)15-13(16)12-10(14)7-8-17-12/h3-8H,2,14H2,1H3,(H,15,16).
What are the key properties of 3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide?
3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide has a molecular weight of 246.34 g/mol, XLogP of 3.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 61091897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).