2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide

C17H19ClN2O2 — CID 9099219

IUPAC2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)CNc1cccc(Cl)c1C
InChIInChI=1S/C17H19ClN2O2/c1-11-7-8-16(22-3)15(9-11)20-17(21)10-19-14-6-4-5-13(18)12(14)2/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyGVUDRCZRWHMGBZ-UHFFFAOYSA-N
MW318.80 g/mol
LogP4.02
Rot. Bonds5

About 2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide

2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide (PubChem CID 9099219) has the molecular formula C17H19ClN2O2 and a molecular weight of 318.80 g/mol. Its IUPAC name is 2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide
PubChem CID9099219
Molecular FormulaC17H19ClN2O2
Molecular Weight318.80 g/mol
Exact Mass318.11
IUPAC Name2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)CNc1cccc(Cl)c1C
InChIInChI=1S/C17H19ClN2O2/c1-11-7-8-16(22-3)15(9-11)20-17(21)10-19-14-6-4-5-13(18)12(14)2/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyGVUDRCZRWHMGBZ-UHFFFAOYSA-N
XLogP4.02
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.80
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-2-methylphenyl)-N'-(2-methoxy-5-methylphenyl)propanediamide
CID 108955088
N-(2,3-dimethylphenyl)-2-(2-methoxy-5-methylanilino)acetamide
CID 9099909
2-(2,4-dichloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 26417516
2-(2-iodoanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 26506643
2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 33169745
N-(2-methoxy-5-methylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-1-ylamino)acetamide
CID 46797713
2-(3,4-dichloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 9098774
2-(3-chloro-2-methylanilino)-N-[(3,4-dimethoxyphenyl)methylideneamino]acetamide
CID 4629127
2-(2,5-dimethylanilino)-N-(2-methoxyphenyl)acetamide
CID 9079653
N-(4-chloro-2,5-dimethoxyphenyl)-3-(3-chloro-2-methylanilino)propanamide
CID 109038365
2-(2-fluoroanilino)-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]acetamide
CID 26507284
N-(3-chloro-2-methylphenyl)-2-(2,4-dimethoxy-3-methylsulfonylanilino)acetamide
CID 22307377

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide?
The IUPAC name of 2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide (CID 9099219) is 2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide?
The canonical SMILES for 2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide is COc1ccc(C)cc1NC(=O)CNc1cccc(Cl)c1C.
What is the InChIKey of 2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide?
The InChIKey is GVUDRCZRWHMGBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O2/c1-11-7-8-16(22-3)15(9-11)20-17(21)10-19-14-6-4-5-13(18)12(14)2/h4-9,19H,10H2,1-3H3,(H,20,21).
What are the key properties of 2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide?
2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide has a molecular weight of 318.80 g/mol, XLogP of 4.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide is sourced from PubChem (CID 9099219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).