N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide

C13H11Cl2NO2S — CID 71910459

IUPACN-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide
SMILESCOc1csc(C(=O)N(C)c2c(Cl)cccc2Cl)c1
InChIInChI=1S/C13H11Cl2NO2S/c1-16(12-9(14)4-3-5-10(12)15)13(17)11-6-8(18-2)7-19-11/h3-7H,1-2H3
InChIKeyYDPGAIOENGHHGE-UHFFFAOYSA-N
MW316.21 g/mol
LogP4.34
Rot. Bonds3

About N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide

N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide (PubChem CID 71910459) has the molecular formula C13H11Cl2NO2S and a molecular weight of 316.21 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide
PubChem CID71910459
Molecular FormulaC13H11Cl2NO2S
Molecular Weight316.21 g/mol
Exact Mass314.99
IUPAC NameN-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide
SMILESCOc1csc(C(=O)N(C)c2c(Cl)cccc2Cl)c1
InChIInChI=1S/C13H11Cl2NO2S/c1-16(12-9(14)4-3-5-10(12)15)13(17)11-6-8(18-2)7-19-11/h3-7H,1-2H3
InChIKeyYDPGAIOENGHHGE-UHFFFAOYSA-N
XLogP4.34
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.21
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxyphenyl)-4-methoxy-N-methylthiophene-2-carboxamide
CID 107735872
4-methoxy-N-methyl-N-(4-sulfamoylphenyl)thiophene-2-carboxamide
CID 81119223
N-[(3-aminophenyl)methyl]-4-methoxy-N-methylthiophene-2-carboxamide
CID 81116579
N,N-bis(2-hydroxyethyl)-4-methoxythiophene-2-carboxamide
CID 81122072
N-[(3-chlorocyclobutyl)methyl]-4-methoxy-N-methylthiophene-2-carboxamide
CID 81129766
2-chloro-1-(4-methoxythiophen-2-yl)ethanone
CID 81140445
N-[(1-benzylpyrrolidin-3-yl)methyl]-4-methoxy-N-methylthiophene-2-carboxamide
CID 136511981
N-(2-chlorocyclohexyl)-4-methoxy-N-methylthiophene-2-carboxamide
CID 102638182
4-methoxy-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide
CID 81122595
N-(2-amino-2-hydroxyiminoethyl)-4-methoxy-N-methylthiophene-2-carboxamide
CID 81124563
(2-chloro-4,5-dimethoxyphenyl)-(4-methoxythiophen-2-yl)methanone
CID 81126532
(2-chloro-4,5-dimethylphenyl)-(4-methoxythiophen-2-yl)methanone
CID 115483503

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide?
The IUPAC name of N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide (CID 71910459) is N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide is COc1csc(C(=O)N(C)c2c(Cl)cccc2Cl)c1.
What is the InChIKey of N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide?
The InChIKey is YDPGAIOENGHHGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2NO2S/c1-16(12-9(14)4-3-5-10(12)15)13(17)11-6-8(18-2)7-19-11/h3-7H,1-2H3.
What are the key properties of N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide?
N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide has a molecular weight of 316.21 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-4-methoxy-N-methylthiophene-2-carboxamide is sourced from PubChem (CID 71910459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).