N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide

C14H15NOS — CID 8839481

IUPACN-(2-ethylphenyl)-3-methylthiophene-2-carboxamide
SMILESCCc1ccccc1NC(=O)c1sccc1C
InChIInChI=1S/C14H15NOS/c1-3-11-6-4-5-7-12(11)15-14(16)13-10(2)8-9-17-13/h4-9H,3H2,1-2H3,(H,15,16)
InChIKeyOGLBNDPTVGIAEQ-UHFFFAOYSA-N
MW245.35 g/mol
LogP3.87
Rot. Bonds3

About N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide

N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide (PubChem CID 8839481) has the molecular formula C14H15NOS and a molecular weight of 245.35 g/mol. Its IUPAC name is N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-3-methylthiophene-2-carboxamide
PubChem CID8839481
Molecular FormulaC14H15NOS
Molecular Weight245.35 g/mol
Exact Mass245.09
IUPAC NameN-(2-ethylphenyl)-3-methylthiophene-2-carboxamide
SMILESCCc1ccccc1NC(=O)c1sccc1C
InChIInChI=1S/C14H15NOS/c1-3-11-6-4-5-7-12(11)15-14(16)13-10(2)8-9-17-13/h4-9H,3H2,1-2H3,(H,15,16)
InChIKeyOGLBNDPTVGIAEQ-UHFFFAOYSA-N
XLogP3.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(aminomethyl)phenyl]-3-methylthiophene-2-carboxamide
CID 64894662
N-[2-(chloromethyl)phenyl]-3-methylthiophene-2-carboxamide
CID 114298265
3-methyl-N-[2-(methylsulfinylmethyl)phenyl]thiophene-2-carboxamide
CID 86815311
3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide
CID 8714089
3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide
CID 61091897
2-[(3-methylthiophene-2-carbonyl)amino]benzoic acid
CID 24708997
[2-[(3-methylthiophene-2-carbonyl)amino]phenyl]boronic acid
CID 58689740
N-(2,3-dimethylphenyl)-3-methylthiophene-2-carboxamide
CID 7947060
N-(2-anilinophenyl)-3-methylthiophene-2-carboxamide
CID 112770069
N-(2-tert-butylphenyl)-3-methylthiophene-2-carboxamide
CID 26515720
N-[2-(4,4-dimethylhexan-2-yl)phenyl]-3-methylthiophene-2-carboxamide
CID 58812874
N-[2-(4-hydroxybut-1-ynyl)phenyl]-3-methylthiophene-2-carboxamide
CID 60803351

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide (CID 8839481) is N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide is CCc1ccccc1NC(=O)c1sccc1C.
What is the InChIKey of N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide?
The InChIKey is OGLBNDPTVGIAEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NOS/c1-3-11-6-4-5-7-12(11)15-14(16)13-10(2)8-9-17-13/h4-9H,3H2,1-2H3,(H,15,16).
What are the key properties of N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide?
N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide has a molecular weight of 245.35 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide is sourced from PubChem (CID 8839481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).