N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide

C16H17ClN2O2 — CID 9080460

IUPACN-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide
SMILESCOc1ccccc1NCC(=O)Nc1ccc(C)c(Cl)c1
InChIInChI=1S/C16H17ClN2O2/c1-11-7-8-12(9-13(11)17)19-16(20)10-18-14-5-3-4-6-15(14)21-2/h3-9,18H,10H2,1-2H3,(H,19,20)
InChIKeyONRHHARFTKTWHK-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.71
Rot. Bonds5

About N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide

N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide (PubChem CID 9080460) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide.

Molecular Properties

Compound NameN-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide
PubChem CID9080460
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide
SMILESCOc1ccccc1NCC(=O)Nc1ccc(C)c(Cl)c1
InChIInChI=1S/C16H17ClN2O2/c1-11-7-8-12(9-13(11)17)19-16(20)10-18-14-5-3-4-6-15(14)21-2/h3-9,18H,10H2,1-2H3,(H,19,20)
InChIKeyONRHHARFTKTWHK-UHFFFAOYSA-N
XLogP3.71
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dichlorophenyl)-2-(2-methoxyanilino)acetamide
CID 9080426
N-(3-chloro-4-methylphenyl)-2-(2-prop-2-enoxyanilino)acetamide
CID 54824696
N-[3-[[2-(2-methoxyanilino)-2-oxoethyl]amino]-4-methylphenyl]propanamide
CID 87029088
[2-(3-chloro-4-methylanilino)-2-oxoethyl]-[2-(2-methoxyanilino)-2-oxoethyl]-propylazanium
CID 9168816
2-(2-methoxyanilino)-N-phenylacetamide
CID 7636827
N'-(5-chloro-2-methoxyphenyl)-N-(3-chloro-4-methylphenyl)propanediamide
CID 108955242
2-(5-chloro-2-methoxyanilino)-N-(3,4-dichlorophenyl)acetamide
CID 109008877
N-(3-chloro-4-methoxyphenyl)-2-(2,4,5-trichloroanilino)acetamide
CID 54816552
(2R)-N-(3-chloro-4-methylphenyl)-2-[2-(2-methoxyanilino)-2-oxoethyl]sulfanylpropanamide
CID 7731757
N-(3-chloro-4-methylphenyl)-2-[2-(2-methoxyanilino)-2-oxoethyl]sulfanylpropanamide
CID 44639864
N-(3-chloro-4-methylphenyl)-N'-(2-chlorophenyl)propanediamide
CID 108954873
N-(3-chloro-4-methoxyphenyl)-3-(3-chloro-4-methylanilino)propanamide
CID 109038668

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide?
The IUPAC name of N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide (CID 9080460) is N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide.
What is the SMILES notation for N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide?
The canonical SMILES for N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide is COc1ccccc1NCC(=O)Nc1ccc(C)c(Cl)c1.
What is the InChIKey of N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide?
The InChIKey is ONRHHARFTKTWHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-11-7-8-12(9-13(11)17)19-16(20)10-18-14-5-3-4-6-15(14)21-2/h3-9,18H,10H2,1-2H3,(H,19,20).
What are the key properties of N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide?
N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide has a molecular weight of 304.78 g/mol, XLogP of 3.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methylphenyl)-2-(2-methoxyanilino)acetamide is sourced from PubChem (CID 9080460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).