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

C16H16ClNO2 — CID 759065

IUPACN-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2cccc(Cl)c2C)cc1
InChIInChI=1S/C16H16ClNO2/c1-11-6-8-13(9-7-11)20-10-16(19)18-15-5-3-4-14(17)12(15)2/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyDQAGXLNEINKCCX-UHFFFAOYSA-N
MW289.76 g/mol
LogP3.97
Rot. Bonds4

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

N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide (PubChem CID 759065) has the molecular formula C16H16ClNO2 and a molecular weight of 289.76 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide
PubChem CID759065
Molecular FormulaC16H16ClNO2
Molecular Weight289.76 g/mol
Exact Mass289.09
IUPAC NameN-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2cccc(Cl)c2C)cc1
InChIInChI=1S/C16H16ClNO2/c1-11-6-8-13(9-7-11)20-10-16(19)18-15-5-3-4-14(17)12(15)2/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyDQAGXLNEINKCCX-UHFFFAOYSA-N
XLogP3.97
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.76
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-2-methylphenyl)-2-(3,5-dimethylphenoxy)acetamide
CID 679560
N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide
CID 31507595
[2-(3-chloro-2-methylanilino)-2-oxoethyl] 3-(4-methylphenoxy)propanoate
CID 7840675
N-(3-chloro-2-methylphenyl)-4-oxo-4-[2-[2-(4-phenylphenoxy)acetyl]hydrazinyl]butanamide
CID 4512967
N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 835994
2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide
CID 39107715
4-[2-[2-(4-bromophenoxy)acetyl]hydrazinyl]-N-(3-chloro-2-methylphenyl)-4-oxobutanamide
CID 4501866
2-(3-acetamidophenoxy)-N-(3-chloro-2-methylphenyl)acetamide
CID 964555
4-[2-(3-chloro-2-methylanilino)-2-oxoethoxy]-N-(4-fluorophenyl)benzamide
CID 1191658
2-(4-methylphenoxy)-N-(2-methylphenyl)acetamide
CID 836156
N-(2-chloro-3-pyridinyl)-2-(4-methylphenoxy)acetamide
CID 823681
N-(3-chloro-2-methylphenyl)-2-[4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenoxy]acetamide
CID 25238000

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide (CID 759065) is N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide is Cc1ccc(OCC(=O)Nc2cccc(Cl)c2C)cc1.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide?
The InChIKey is DQAGXLNEINKCCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO2/c1-11-6-8-13(9-7-11)20-10-16(19)18-15-5-3-4-14(17)12(15)2/h3-9H,10H2,1-2H3,(H,18,19).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide?
N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide has a molecular weight of 289.76 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 759065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).