N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide

C17H18ClNO2 — CID 835994

IUPACN-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide
SMILESCc1cccc(C)c1OCC(=O)Nc1cccc(Cl)c1C
InChIInChI=1S/C17H18ClNO2/c1-11-6-4-7-12(2)17(11)21-10-16(20)19-15-9-5-8-14(18)13(15)3/h4-9H,10H2,1-3H3,(H,19,20)
InChIKeyPZMUSTLZYZLBTQ-UHFFFAOYSA-N
MW303.79 g/mol
LogP4.28
Rot. Bonds4

About N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide

N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide (PubChem CID 835994) has the molecular formula C17H18ClNO2 and a molecular weight of 303.79 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide
PubChem CID835994
Molecular FormulaC17H18ClNO2
Molecular Weight303.79 g/mol
Exact Mass303.10
IUPAC NameN-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide
SMILESCc1cccc(C)c1OCC(=O)Nc1cccc(Cl)c1C
InChIInChI=1S/C17H18ClNO2/c1-11-6-4-7-12(2)17(11)21-10-16(20)19-15-9-5-8-14(18)13(15)3/h4-9H,10H2,1-3H3,(H,19,20)
InChIKeyPZMUSTLZYZLBTQ-UHFFFAOYSA-N
XLogP4.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.79
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-2-(2,3,6-trimethylphenoxy)acetamide
CID 731196
N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide
CID 759065
N-(3-chloro-2-methylphenyl)-2-(3,5-dimethylphenoxy)acetamide
CID 679560
4-[2-[2-(4-bromo-2,6-dimethylphenoxy)acetyl]hydrazinyl]-N-(3-chloro-2-methylphenyl)-4-oxobutanamide
CID 3341674
[(2S)-1-(3-chloro-2-methylanilino)-1-oxopropan-2-yl] 2-(2,6-dimethylphenoxy)acetate
CID 8953446
2-(2-amino-6-chlorophenoxy)-N-(2-methylphenyl)acetamide
CID 107716023
[2-(3-chloro-2-methylanilino)-2-oxoethyl] 2-(2,3-dimethylphenoxy)acetate
CID 7982074
N,N'-bis(3-chloro-2-methylphenyl)butanediamide
CID 1226548
2-(3-aminophenoxy)-N-(3-chloro-2-methylphenyl)acetamide
CID 39107715
2-[[2-(2,6-dimethylphenoxy)acetyl]amino]benzoic acid
CID 5046071
N-(5-chloro-2-hydroxyphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 838186
N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 28867327

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide (CID 835994) is N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide is Cc1cccc(C)c1OCC(=O)Nc1cccc(Cl)c1C.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide?
The InChIKey is PZMUSTLZYZLBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO2/c1-11-6-4-7-12(2)17(11)21-10-16(20)19-15-9-5-8-14(18)13(15)3/h4-9H,10H2,1-3H3,(H,19,20).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide?
N-(3-chloro-2-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide has a molecular weight of 303.79 g/mol, XLogP of 4.28, 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-(2,6-dimethylphenoxy)acetamide is sourced from PubChem (CID 835994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).