2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide

C19H15Cl2NO2S — CID 55888940

IUPAC2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide
SMILESCc1ccc(NC(=O)c2cc(Cl)sc2Cl)c(OCc2ccccc2)c1
InChIInChI=1S/C19H15Cl2NO2S/c1-12-7-8-15(22-19(23)14-10-17(20)25-18(14)21)16(9-12)24-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,22,23)
InChIKeyVWUMGESRGOZZTK-UHFFFAOYSA-N
MW392.31 g/mol
LogP6.19
Rot. Bonds5

About 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide

2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide (PubChem CID 55888940) has the molecular formula C19H15Cl2NO2S and a molecular weight of 392.31 g/mol. Its IUPAC name is 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide
PubChem CID55888940
Molecular FormulaC19H15Cl2NO2S
Molecular Weight392.31 g/mol
Exact Mass391.02
IUPAC Name2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide
SMILESCc1ccc(NC(=O)c2cc(Cl)sc2Cl)c(OCc2ccccc2)c1
InChIInChI=1S/C19H15Cl2NO2S/c1-12-7-8-15(22-19(23)14-10-17(20)25-18(14)21)16(9-12)24-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,22,23)
InChIKeyVWUMGESRGOZZTK-UHFFFAOYSA-N
XLogP6.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.31
LogP ≤ 56.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-methyl-2-phenylmethoxyphenyl)acetamide
CID 47311961
N-chloro-4-methyl-2-phenylmethoxyaniline
CID 87749280
N-(4-methyl-2-phenylmethoxyphenyl)-4-nitrobenzamide
CID 22010922
N-(2-hydroxy-5-methylphenyl)-2-phenylmethoxybenzamide
CID 4946343
2-(2-methoxyethylamino)-N-(4-methyl-2-phenylmethoxyphenyl)acetamide
CID 119726802
2,5-dichloro-N-phenylmethoxythiophene-3-carboxamide
CID 41450667
1-(2-hydroxyethyl)-1-methyl-3-(4-methyl-2-phenylmethoxyphenyl)urea
CID 111431455
N-(5-chloro-2-methylphenyl)-2-phenylmethoxybenzamide
CID 4946400
4-amino-3-methoxy-N-(4-methyl-2-phenylmethoxyphenyl)butanamide
CID 120588954
3-methyl-N-(4-methyl-2-phenylmethoxyphenyl)pyrrolidine-1-carboxamide
CID 86877135
2,5-dichloro-N-[[4-(phenylmethoxymethyl)phenyl]methyl]thiophene-3-carboxamide
CID 55694329
2-chloro-N-[4-methyl-2-[(2-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl]benzamide
CID 53092430

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide?
The IUPAC name of 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide (CID 55888940) is 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide.
What is the SMILES notation for 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide?
The canonical SMILES for 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide is Cc1ccc(NC(=O)c2cc(Cl)sc2Cl)c(OCc2ccccc2)c1.
What is the InChIKey of 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide?
The InChIKey is VWUMGESRGOZZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2NO2S/c1-12-7-8-15(22-19(23)14-10-17(20)25-18(14)21)16(9-12)24-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,22,23).
What are the key properties of 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide?
2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide has a molecular weight of 392.31 g/mol, XLogP of 6.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(4-methyl-2-phenylmethoxyphenyl)thiophene-3-carboxamide is sourced from PubChem (CID 55888940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).