3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide

C13H13NOS — CID 8714089

IUPAC3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide
SMILESCc1ccccc1NC(=O)c1sccc1C
InChIInChI=1S/C13H13NOS/c1-9-5-3-4-6-11(9)14-13(15)12-10(2)7-8-16-12/h3-8H,1-2H3,(H,14,15)
InChIKeySXVBNNVLTCTNRG-UHFFFAOYSA-N
MW231.32 g/mol
LogP3.62
Rot. Bonds2

About 3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide

3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide (PubChem CID 8714089) has the molecular formula C13H13NOS and a molecular weight of 231.32 g/mol. Its IUPAC name is 3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide
PubChem CID8714089
Molecular FormulaC13H13NOS
Molecular Weight231.32 g/mol
Exact Mass231.07
IUPAC Name3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide
SMILESCc1ccccc1NC(=O)c1sccc1C
InChIInChI=1S/C13H13NOS/c1-9-5-3-4-6-11(9)14-13(15)12-10(2)7-8-16-12/h3-8H,1-2H3,(H,14,15)
InChIKeySXVBNNVLTCTNRG-UHFFFAOYSA-N
XLogP3.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.32
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dimethylphenyl)-3-methylthiophene-2-carboxamide
CID 7947060
2-[(3-methylthiophene-2-carbonyl)amino]benzoic acid
CID 24708997
[2-[(3-methylthiophene-2-carbonyl)amino]phenyl]boronic acid
CID 58689740
N-(2-ethylphenyl)-3-methylthiophene-2-carboxamide
CID 8839481
N-(2-anilinophenyl)-3-methylthiophene-2-carboxamide
CID 112770069
N-(2-tert-butylphenyl)-3-methylthiophene-2-carboxamide
CID 26515720
N-[2-(aminomethyl)phenyl]-3-methylthiophene-2-carboxamide
CID 64894662
N-[2-(chloromethyl)phenyl]-3-methylthiophene-2-carboxamide
CID 114298265
N-(2-carbamothioyl-3-methylphenyl)-3-methylthiophene-2-carboxamide
CID 107805808
3-methyl-N-[2-(methylsulfinylmethyl)phenyl]thiophene-2-carboxamide
CID 86815311
N-[2-[(Z)-N'-hydroxycarbamimidoyl]-3-methylphenyl]-3-methylthiophene-2-carboxamide
CID 107800790
N-(4-amino-2-methylphenyl)-3-methylthiophene-2-carboxamide
CID 24696696

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide?
The IUPAC name of 3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide (CID 8714089) is 3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide?
The canonical SMILES for 3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide is Cc1ccccc1NC(=O)c1sccc1C.
What is the InChIKey of 3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide?
The InChIKey is SXVBNNVLTCTNRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NOS/c1-9-5-3-4-6-11(9)14-13(15)12-10(2)7-8-16-12/h3-8H,1-2H3,(H,14,15).
What are the key properties of 3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide?
3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide has a molecular weight of 231.32 g/mol, XLogP of 3.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 8714089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).