N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide

C16H15Cl3N2O3 — CID 42026344

IUPACN-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide
SMILESCOc1cc(NC(=O)CNc2ccc(Cl)c(Cl)c2)c(OC)cc1Cl
InChIInChI=1S/C16H15Cl3N2O3/c1-23-14-7-13(15(24-2)6-12(14)19)21-16(22)8-20-9-3-4-10(17)11(18)5-9/h3-7,20H,8H2,1-2H3,(H,21,22)
InChIKeyVHBJYZADWFPBSV-UHFFFAOYSA-N
MW389.67 g/mol
LogP4.71
Rot. Bonds6

About N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide

N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide (PubChem CID 42026344) has the molecular formula C16H15Cl3N2O3 and a molecular weight of 389.67 g/mol. Its IUPAC name is N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide.

Molecular Properties

Compound NameN-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide
PubChem CID42026344
Molecular FormulaC16H15Cl3N2O3
Molecular Weight389.67 g/mol
Exact Mass388.01
IUPAC NameN-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide
SMILESCOc1cc(NC(=O)CNc2ccc(Cl)c(Cl)c2)c(OC)cc1Cl
InChIInChI=1S/C16H15Cl3N2O3/c1-23-14-7-13(15(24-2)6-12(14)19)21-16(22)8-20-9-3-4-10(17)11(18)5-9/h3-7,20H,8H2,1-2H3,(H,21,22)
InChIKeyVHBJYZADWFPBSV-UHFFFAOYSA-N
XLogP4.71
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.67
LogP ≤ 54.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2,5-dimethoxyphenyl)-2-(3-chloro-4-methoxyanilino)acetamide
CID 42026868
2-(4-chloro-2,5-dimethoxyanilino)-N-(3,4-dichlorophenyl)acetamide
CID 9106808
2-(3,4-dichloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 9098774
2-(3-bromoanilino)-N-(4-chloro-2,5-dimethoxyphenyl)acetamide
CID 42026315
2-(3,4-dichloroanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9098792
N-(4-chloro-2,5-dimethoxyphenyl)-2-(5-chloro-2-methoxyanilino)acetamide
CID 42026368
N-(4-chloro-2,5-dimethoxyphenyl)-2-[4-methyl-3-(5-methyltetrazol-1-yl)anilino]acetamide
CID 56514408
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(3,4-difluoroanilino)acetamide
CID 109011257
N-(4-chloro-2,5-dimethoxyphenyl)-2-(2,5-dimethoxyanilino)acetamide
CID 109009482
N-(3,4-dichlorophenyl)-2-(2-methoxyanilino)acetamide
CID 9080426
2-(3-chloro-4-methoxyanilino)-N-(2,4-dimethylphenyl)acetamide
CID 9101796
N-(5-tert-butyl-2-methoxyphenyl)-2-(4-chloro-2,5-dimethoxyanilino)acetamide
CID 4885055

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide?
The IUPAC name of N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide (CID 42026344) is N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide.
What is the SMILES notation for N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide?
The canonical SMILES for N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide is COc1cc(NC(=O)CNc2ccc(Cl)c(Cl)c2)c(OC)cc1Cl.
What is the InChIKey of N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide?
The InChIKey is VHBJYZADWFPBSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl3N2O3/c1-23-14-7-13(15(24-2)6-12(14)19)21-16(22)8-20-9-3-4-10(17)11(18)5-9/h3-7,20H,8H2,1-2H3,(H,21,22).
What are the key properties of N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide?
N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide has a molecular weight of 389.67 g/mol, XLogP of 4.71, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2,5-dimethoxyphenyl)-2-(3,4-dichloroanilino)acetamide is sourced from PubChem (CID 42026344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).