2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide

C15H12ClF2NO2 — CID 3945608

IUPAC2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide
SMILESCc1cc(Cl)ccc1OCC(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C15H12ClF2NO2/c1-9-6-10(16)2-5-14(9)21-8-15(20)19-13-4-3-11(17)7-12(13)18/h2-7H,8H2,1H3,(H,19,20)
InChIKeyQSKGZSROHOPAFA-UHFFFAOYSA-N
MW311.72 g/mol
LogP3.94
Rot. Bonds4

About 2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide

2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide (PubChem CID 3945608) has the molecular formula C15H12ClF2NO2 and a molecular weight of 311.72 g/mol. Its IUPAC name is 2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide
PubChem CID3945608
Molecular FormulaC15H12ClF2NO2
Molecular Weight311.72 g/mol
Exact Mass311.05
IUPAC Name2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide
SMILESCc1cc(Cl)ccc1OCC(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C15H12ClF2NO2/c1-9-6-10(16)2-5-14(9)21-8-15(20)19-13-4-3-11(17)7-12(13)18/h2-7H,8H2,1H3,(H,19,20)
InChIKeyQSKGZSROHOPAFA-UHFFFAOYSA-N
XLogP3.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.72
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chloro-2-methylphenoxy)-N-(2,4-dichlorophenyl)acetamide
CID 923084
N-(2-amino-4-chlorophenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 29045302
2-(4-chloro-2-methylphenoxy)-N-(2-chloro-4-methylphenyl)acetamide
CID 7926730
[2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 2-(4-chloro-2-methylphenoxy)acetate
CID 35564996
2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-N-(2,3,4-trifluorophenyl)acetamide
CID 2527865
N-(4-chloro-2-fluorophenyl)-2-(2-fluorophenoxy)acetamide
CID 7961385
[2-(2,4-difluoroanilino)-2-oxoethyl] 2-(2-methylphenoxy)acetate
CID 2555443
2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-N-(4-fluorophenyl)acetamide
CID 8709029
2-(4-chloro-2-methylphenoxy)-N-[(4-fluorophenyl)methyl]acetamide
CID 3624933
N-(3-amino-4-fluorophenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 29036010
4-(4-chloro-2-methylphenoxy)-N-(5-fluoro-2-methylphenyl)butanamide
CID 18226308
2-(4-bromo-2-fluorophenoxy)-N-(2,4-difluorophenyl)acetamide
CID 2523027

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide?
The IUPAC name of 2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide (CID 3945608) is 2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide.
What is the SMILES notation for 2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide?
The canonical SMILES for 2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide is Cc1cc(Cl)ccc1OCC(=O)Nc1ccc(F)cc1F.
What is the InChIKey of 2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide?
The InChIKey is QSKGZSROHOPAFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClF2NO2/c1-9-6-10(16)2-5-14(9)21-8-15(20)19-13-4-3-11(17)7-12(13)18/h2-7H,8H2,1H3,(H,19,20).
What are the key properties of 2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide?
2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide has a molecular weight of 311.72 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide is sourced from PubChem (CID 3945608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).