2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide

C24H19NO2S2 — CID 121131732

IUPAC2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide
SMILESO=C(Cc1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)c2cccs2)s1
InChIInChI=1S/C24H19NO2S2/c26-23(15-17-8-10-19(11-9-17)18-5-2-1-3-6-18)25-16-20-12-13-22(29-20)24(27)21-7-4-14-28-21/h1-14H,15-16H2,(H,25,26)
InChIKeyCSXFKYIGUKWATP-UHFFFAOYSA-N
MW417.56 g/mol
LogP5.57
Rot. Bonds7

About 2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide

2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide (PubChem CID 121131732) has the molecular formula C24H19NO2S2 and a molecular weight of 417.56 g/mol. Its IUPAC name is 2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide
PubChem CID121131732
Molecular FormulaC24H19NO2S2
Molecular Weight417.56 g/mol
Exact Mass417.09
IUPAC Name2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide
SMILESO=C(Cc1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)c2cccs2)s1
InChIInChI=1S/C24H19NO2S2/c26-23(15-17-8-10-19(11-9-17)18-5-2-1-3-6-18)25-16-20-12-13-22(29-20)24(27)21-7-4-14-28-21/h1-14H,15-16H2,(H,25,26)
InChIKeyCSXFKYIGUKWATP-UHFFFAOYSA-N
XLogP5.57
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.56
LogP ≤ 55.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-[hydroxy(thiophen-2-yl)methyl]thiophen-2-yl]methyl]-2-(4-phenylphenyl)acetamide
CID 90583549
1-(3-phenylpropyl)-3-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]urea
CID 121131937
2-(4-methylphenoxy)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide
CID 121131670
1-prop-2-enyl-3-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]urea
CID 121131918
3,5-dimethyl-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]benzamide
CID 121131645
N-[(5-benzoylthiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide
CID 90612901
N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]-1,3-benzodioxole-5-carboxamide
CID 71803346
N-[[5-[hydroxy(phenyl)methyl]thiophen-2-yl]methyl]-2-(4-phenylphenyl)acetamide
CID 121134188
3,4-dimethyl-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]benzamide
CID 71803337
3-fluoro-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]benzamide
CID 121131635
2-oxo-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]chromene-3-carboxamide
CID 121131705
4-methyl-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]thiadiazole-5-carboxamide
CID 121131639

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide?
The IUPAC name of 2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide (CID 121131732) is 2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide.
What is the SMILES notation for 2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide?
The canonical SMILES for 2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide is O=C(Cc1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)c2cccs2)s1.
What is the InChIKey of 2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide?
The InChIKey is CSXFKYIGUKWATP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO2S2/c26-23(15-17-8-10-19(11-9-17)18-5-2-1-3-6-18)25-16-20-12-13-22(29-20)24(27)21-7-4-14-28-21/h1-14H,15-16H2,(H,25,26).
What are the key properties of 2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide?
2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide has a molecular weight of 417.56 g/mol, XLogP of 5.57, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenyl)-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]acetamide is sourced from PubChem (CID 121131732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).