N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide

C15H15NO2S — CID 65237582

IUPACN-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)c2cc(C)c(C)s2)cc1
InChIInChI=1S/C15H15NO2S/c1-9-8-14(19-10(9)2)15(18)12-4-6-13(7-5-12)16-11(3)17/h4-8H,1-3H3,(H,16,17)
InChIKeyXGNKVIZDBWMBOH-UHFFFAOYSA-N
MW273.36 g/mol
LogP3.55
Rot. Bonds3

About N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide

N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide (PubChem CID 65237582) has the molecular formula C15H15NO2S and a molecular weight of 273.36 g/mol. Its IUPAC name is N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide
PubChem CID65237582
Molecular FormulaC15H15NO2S
Molecular Weight273.36 g/mol
Exact Mass273.08
IUPAC NameN-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)c2cc(C)c(C)s2)cc1
InChIInChI=1S/C15H15NO2S/c1-9-8-14(19-10(9)2)15(18)12-4-6-13(7-5-12)16-11(3)17/h4-8H,1-3H3,(H,16,17)
InChIKeyXGNKVIZDBWMBOH-UHFFFAOYSA-N
XLogP3.55
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4,5-dimethylthiophen-2-yl)-(1H-pyrrol-3-yl)methanone
CID 65237167
N-(4-ethylphenyl)-4,5-dimethylthiophene-2-carboxamide
CID 31494324
N-[4-(4-hydroxybenzoyl)phenyl]acetamide
CID 91710939
N-[4-(5-chloro-2-methylbenzoyl)phenyl]acetamide
CID 82883579
N-(4-amino-3-methylphenyl)-4,5-dimethylthiophene-2-carboxamide
CID 65237624
N-[4-(4-iodobenzoyl)phenyl]acetamide
CID 43337938
N-[4-(3,5-difluorobenzoyl)phenyl]acetamide
CID 43337955
N-[4-(2,4,6-trifluorobenzoyl)phenyl]acetamide
CID 65101340
(5-bromo-4-methylthiophen-2-yl)-(4-methylphenyl)methanone
CID 79982080
(4,5-dimethylthiophen-2-yl)-(3-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanone
CID 65237310
N-(4-methylphenyl)acetamide
CID 7684
N-(3-carbamoylphenyl)-4,5-dimethylthiophene-2-carboxamide
CID 78779650

Frequently Asked Questions

What is the IUPAC name of N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide?
The IUPAC name of N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide (CID 65237582) is N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide.
What is the SMILES notation for N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide?
The canonical SMILES for N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide is CC(=O)Nc1ccc(C(=O)c2cc(C)c(C)s2)cc1.
What is the InChIKey of N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide?
The InChIKey is XGNKVIZDBWMBOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2S/c1-9-8-14(19-10(9)2)15(18)12-4-6-13(7-5-12)16-11(3)17/h4-8H,1-3H3,(H,16,17).
What are the key properties of N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide?
N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide has a molecular weight of 273.36 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4,5-dimethylthiophene-2-carbonyl)phenyl]acetamide is sourced from PubChem (CID 65237582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).