N-(2,3-dimethylphenyl)thiophene-2-carboxamide

C13H13NOS — CID 2302632

IUPACN-(2,3-dimethylphenyl)thiophene-2-carboxamide
SMILESCc1cccc(NC(=O)c2cccs2)c1C
InChIInChI=1S/C13H13NOS/c1-9-5-3-6-11(10(9)2)14-13(15)12-7-4-8-16-12/h3-8H,1-2H3,(H,14,15)
InChIKeyUQQWMPABSUZYGP-UHFFFAOYSA-N
MW231.32 g/mol
LogP3.62
Rot. Bonds2

About N-(2,3-dimethylphenyl)thiophene-2-carboxamide

N-(2,3-dimethylphenyl)thiophene-2-carboxamide (PubChem CID 2302632) has the molecular formula C13H13NOS and a molecular weight of 231.32 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)thiophene-2-carboxamide
PubChem CID2302632
Molecular FormulaC13H13NOS
Molecular Weight231.32 g/mol
Exact Mass231.07
IUPAC NameN-(2,3-dimethylphenyl)thiophene-2-carboxamide
SMILESCc1cccc(NC(=O)c2cccs2)c1C
InChIInChI=1S/C13H13NOS/c1-9-5-3-6-11(10(9)2)14-13(15)12-7-4-8-16-12/h3-8H,1-2H3,(H,14,15)
InChIKeyUQQWMPABSUZYGP-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-(4-aminophenyl)thiophene-2-carboxamide
CID 736373
N-(4-methylphenyl)thiophene-2-carboxamide
CID 2292972
N-(2-methylphenyl)-2-(2-thienyl)acetamide
CID 670140
N-(2-Ethylphenyl)-2-thiophenecarboxamide
CID 765411
N-(4-Fluorophenyl)-2-thiophenecarboxamide
CID 531923
N-[3-[[2-[(dimethylamino)methyl]phenyl]methylcarbamoyl]phenyl]thiophene-2-carboxamide
CID 8197605
N-[3-[[2-(diethylaminomethyl)phenyl]methylcarbamoyl]phenyl]thiophene-2-carboxamide
CID 9074003
N-[3-[[2-[(dipropylamino)methyl]phenyl]methylcarbamoyl]phenyl]thiophene-2-carboxamide
CID 151826414
3-[(4-Methylphenyl)amino]-1-(2-thienyl)-1-propanone
CID 877310
N-(2,3-dihydro-1H-inden-5-yl)thiophene-2-carboxamide
CID 782642
Stk238931
CID 926198
N-(5-Methyl-2-thienyl)benzamide
CID 570111

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)thiophene-2-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)thiophene-2-carboxamide (CID 2302632) is N-(2,3-dimethylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)thiophene-2-carboxamide is Cc1cccc(NC(=O)c2cccs2)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)thiophene-2-carboxamide?
The InChIKey is UQQWMPABSUZYGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NOS/c1-9-5-3-6-11(10(9)2)14-13(15)12-7-4-8-16-12/h3-8H,1-2H3,(H,14,15).
What are the key properties of N-(2,3-dimethylphenyl)thiophene-2-carboxamide?
N-(2,3-dimethylphenyl)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 N-(2,3-dimethylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 2302632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).