N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide

C21H21NO3S — CID 110296925

IUPACN-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide
SMILESCOc1ccc(C(Cc2cccs2)C(=O)Nc2ccccc2OC)cc1
InChIInChI=1S/C21H21NO3S/c1-24-16-11-9-15(10-12-16)18(14-17-6-5-13-26-17)21(23)22-19-7-3-4-8-20(19)25-2/h3-13,18H,14H2,1-2H3,(H,22,23)
InChIKeyVLJDFETYABQNSS-UHFFFAOYSA-N
MW367.47 g/mol
LogP4.73
Rot. Bonds7

About N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide

N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide (PubChem CID 110296925) has the molecular formula C21H21NO3S and a molecular weight of 367.47 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide
PubChem CID110296925
Molecular FormulaC21H21NO3S
Molecular Weight367.47 g/mol
Exact Mass367.12
IUPAC NameN-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide
SMILESCOc1ccc(C(Cc2cccs2)C(=O)Nc2ccccc2OC)cc1
InChIInChI=1S/C21H21NO3S/c1-24-16-11-9-15(10-12-16)18(14-17-6-5-13-26-17)21(23)22-19-7-3-4-8-20(19)25-2/h3-13,18H,14H2,1-2H3,(H,22,23)
InChIKeyVLJDFETYABQNSS-UHFFFAOYSA-N
XLogP4.73
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.47
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide
CID 110296909
2-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]-3-thiophen-2-ylpropanamide
CID 110296913
(3Z)-3-amino-3-hydroxyimino-N-(2-methoxyphenyl)-2-(thiophen-2-ylmethyl)propanamide
CID 43811524
N-(4-methoxybutyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide
CID 110416393
[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl]-methyl-(thiophen-2-ylmethyl)azanium
CID 8516915
1-(4-methoxyphenyl)-2-thiophen-2-ylethanol
CID 62501005
1-(2-methoxyphenyl)-3-[1-(4-methoxyphenyl)propyl]urea
CID 78798433
N-(2-methoxyphenyl)-3-thiophen-2-ylpropanamide
CID 17423672
[(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl] 2-(thiophen-2-ylmethylsulfanyl)acetate
CID 8506121
1-(2-methoxyphenyl)-3-[(1S)-1-(4-methoxyphenyl)-3-methylbutyl]urea
CID 100747414
2-(4-methoxyanilino)-N-(2-methoxyphenyl)propanamide
CID 17397275
(2R)-2-(4-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 925101

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide?
The IUPAC name of N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide (CID 110296925) is N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide is COc1ccc(C(Cc2cccs2)C(=O)Nc2ccccc2OC)cc1.
What is the InChIKey of N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide?
The InChIKey is VLJDFETYABQNSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO3S/c1-24-16-11-9-15(10-12-16)18(14-17-6-5-13-26-17)21(23)22-19-7-3-4-8-20(19)25-2/h3-13,18H,14H2,1-2H3,(H,22,23).
What are the key properties of N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide?
N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide has a molecular weight of 367.47 g/mol, XLogP of 4.73, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-(4-methoxyphenyl)-3-thiophen-2-ylpropanamide is sourced from PubChem (CID 110296925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).