2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide

C15H16N2O3S — CID 16912155

IUPAC2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide
SMILESCOc1ccc(C)cc1CC(=O)Nc1sccc1C(N)=O
InChIInChI=1S/C15H16N2O3S/c1-9-3-4-12(20-2)10(7-9)8-13(18)17-15-11(14(16)19)5-6-21-15/h3-7H,8H2,1-2H3,(H2,16,19)(H,17,18)
InChIKeyNAFDRMZIZLORDF-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.35
Rot. Bonds5

About 2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide

2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide (PubChem CID 16912155) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is 2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide
PubChem CID16912155
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC Name2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide
SMILESCOc1ccc(C)cc1CC(=O)Nc1sccc1C(N)=O
InChIInChI=1S/C15H16N2O3S/c1-9-3-4-12(20-2)10(7-9)8-13(18)17-15-11(14(16)19)5-6-21-15/h3-7H,8H2,1-2H3,(H2,16,19)(H,17,18)
InChIKeyNAFDRMZIZLORDF-UHFFFAOYSA-N
XLogP2.35
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[4-(2-Dimethylaminoethyloxy)phenyl]-2-Ureido-Thiophene-3-Carboxamide
CID 9902908
N-[5-ethyl-3-(4-methoxybenzoyl)-2-thienyl]-2-(1-pyrrolidinyl)acetamide
CID 2814375
2-(4-Methoxybenzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide
CID 675881
2-(3-Methoxybenzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide
CID 961926
2-(3,4-Dimethoxybenzamido)thiophene-3-carboxamide
CID 4106590
Ethyl 4-(4-methoxyphenyl)-2-{[(phenylsulfanyl)acetyl]amino}thiophene-3-carboxylate
CID 1008698
N-[5-ethyl-3-[(4-methoxyphenyl)-oxomethyl]-2-thiophenyl]-2-(4-methyl-1-piperazinyl)acetamide
CID 2814376
2-[2-(2-Methoxyphenyl)acetylamino]-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbo xamide
CID 674573
5-Ethyl-2-{[3-(4-methoxyphenyl)acryloyl]amino}-3-thiophenecarboxylic acid
CID 776614
2-[[(2S)-2-[(4-methoxybenzoyl)amino]-3-methylbutanoyl]amino]thiophene-3-carboxamide
CID 2104820
2-[[4-(Difluoromethoxy)benzoyl]amino]-5-phenylthiophene-3-carboxamide
CID 2132378
5-{[5-Ethyl-3-(4-methoxybenzoyl)-2-thienyl]amino}-3,3-dimethyl-5-oxopentanoic acid
CID 2814703

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide?
The IUPAC name of 2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide (CID 16912155) is 2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide.
What is the SMILES notation for 2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide?
The canonical SMILES for 2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide is COc1ccc(C)cc1CC(=O)Nc1sccc1C(N)=O.
What is the InChIKey of 2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide?
The InChIKey is NAFDRMZIZLORDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-9-3-4-12(20-2)10(7-9)8-13(18)17-15-11(14(16)19)5-6-21-15/h3-7H,8H2,1-2H3,(H2,16,19)(H,17,18).
What are the key properties of 2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide?
2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide has a molecular weight of 304.37 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]thiophene-3-carboxamide is sourced from PubChem (CID 16912155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).