N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide

C14H14N2O2S — CID 110866335

IUPACN-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide
SMILESCc1ccc(C)c(NC(=O)NC(=O)c2cccs2)c1
InChIInChI=1S/C14H14N2O2S/c1-9-5-6-10(2)11(8-9)15-14(18)16-13(17)12-4-3-7-19-12/h3-8H,1-2H3,(H2,15,16,17,18)
InChIKeyUKBDMMLPDMRNIW-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.33
Rot. Bonds2

About N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide

N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide (PubChem CID 110866335) has the molecular formula C14H14N2O2S and a molecular weight of 274.34 g/mol. Its IUPAC name is N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide
PubChem CID110866335
Molecular FormulaC14H14N2O2S
Molecular Weight274.34 g/mol
Exact Mass274.08
IUPAC NameN-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide
SMILESCc1ccc(C)c(NC(=O)NC(=O)c2cccs2)c1
InChIInChI=1S/C14H14N2O2S/c1-9-5-6-10(2)11(8-9)15-14(18)16-13(17)12-4-3-7-19-12/h3-8H,1-2H3,(H2,15,16,17,18)
InChIKeyUKBDMMLPDMRNIW-UHFFFAOYSA-N
XLogP3.33
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dimethylphenyl)thiophene-2-carboxamide;ethane
CID 143815290
N-[2-chloro-5-[(2,5-dimethylphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
CID 26500049
N-[4-methyl-3-(thiophene-2-carbonylamino)phenyl]thiophene-2-carboxamide
CID 838783
N-(5-chloro-2-methylphenyl)thiophene-2-carboxamide
CID 795521
4-methyl-3-(thiophene-2-carbonylamino)benzoate
CID 5122270
N-[(5-chloro-2-methylphenyl)carbamothioyl]thiophene-2-carboxamide
CID 4937653
N-[4-methyl-2-[(2-methylbenzoyl)amino]phenyl]thiophene-2-carboxamide
CID 9324132
2-[(E)-[amino(thiophen-2-yl)methylidene]amino]oxy-N-(2,5-dimethylphenyl)acetamide
CID 51228208
N-[1-(2,5-dimethylphenyl)ethyl]thiophene-2-carboxamide
CID 6468570
N-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]thiophene-2-carboxamide
CID 110866692
N-[1-(2-methoxy-5-methylanilino)-1-oxopropan-2-yl]thiophene-2-carboxamide
CID 46756520
N-[4-methyl-2-[(2-thiophen-2-ylacetyl)amino]phenyl]thiophene-2-carboxamide
CID 3164945

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide?
The IUPAC name of N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide (CID 110866335) is N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide?
The canonical SMILES for N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide is Cc1ccc(C)c(NC(=O)NC(=O)c2cccs2)c1.
What is the InChIKey of N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide?
The InChIKey is UKBDMMLPDMRNIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c1-9-5-6-10(2)11(8-9)15-14(18)16-13(17)12-4-3-7-19-12/h3-8H,1-2H3,(H2,15,16,17,18).
What are the key properties of N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide?
N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide has a molecular weight of 274.34 g/mol, XLogP of 3.33, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethylphenyl)carbamoyl]thiophene-2-carboxamide is sourced from PubChem (CID 110866335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).