2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide

C16H12Cl2F2N2O2 — CID 113180204

IUPAC2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1c(F)cccc1F)c1cccc(Cl)c1Cl
InChIInChI=1S/C16H12Cl2F2N2O2/c1-9(23)22(13-7-2-4-10(17)15(13)18)8-14(24)21-16-11(19)5-3-6-12(16)20/h2-7H,8H2,1H3,(H,21,24)
InChIKeyAAVMBNMNTQKEJY-UHFFFAOYSA-N
MW373.19 g/mol
LogP4.26
Rot. Bonds4

About 2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide

2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide (PubChem CID 113180204) has the molecular formula C16H12Cl2F2N2O2 and a molecular weight of 373.19 g/mol. Its IUPAC name is 2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide
PubChem CID113180204
Molecular FormulaC16H12Cl2F2N2O2
Molecular Weight373.19 g/mol
Exact Mass372.02
IUPAC Name2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1c(F)cccc1F)c1cccc(Cl)c1Cl
InChIInChI=1S/C16H12Cl2F2N2O2/c1-9(23)22(13-7-2-4-10(17)15(13)18)8-14(24)21-16-11(19)5-3-6-12(16)20/h2-7H,8H2,1H3,(H,21,24)
InChIKeyAAVMBNMNTQKEJY-UHFFFAOYSA-N
XLogP4.26
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.19
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-2,3-dichloroanilino)-N-(4-chlorophenyl)acetamide
CID 113180167
2-(N-acetyl-2,3-dichloroanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 113180172
2-(N-acetyl-2,3-dichloroanilino)-N-(3,5-dimethylphenyl)acetamide
CID 113180150
2-(N-acetyl-2,3-dichloroanilino)-N-(3-chloro-4-methylphenyl)acetamide
CID 113180171
2-(N-acetyl-2-fluoroanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113170822
N-(4-acetamidophenyl)-2-(N-acetyl-2-chloroanilino)acetamide
CID 113171239
2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide
CID 113170882
2-(N-acetyl-3-chloro-2-methylanilino)-N-(3,4-difluorophenyl)acetamide
CID 113171824
2-(N-acetyl-2,3-dichloroanilino)-N-prop-2-enylacetamide
CID 113180076
3-(N-acetyl-2-fluoroanilino)-N-(2,6-dichlorophenyl)propanamide
CID 113126804
2-[N-acetyl-4-(diethylamino)-2-methylanilino]-N-(2,6-difluorophenyl)acetamide
CID 113180493
2-(N-acetyl-2,3-dichloroanilino)-N-(1-phenylethyl)acetamide
CID 113180102

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide (CID 113180204) is 2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide is CC(=O)N(CC(=O)Nc1c(F)cccc1F)c1cccc(Cl)c1Cl.
What is the InChIKey of 2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide?
The InChIKey is AAVMBNMNTQKEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Cl2F2N2O2/c1-9(23)22(13-7-2-4-10(17)15(13)18)8-14(24)21-16-11(19)5-3-6-12(16)20/h2-7H,8H2,1H3,(H,21,24).
What are the key properties of 2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide?
2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide has a molecular weight of 373.19 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2,3-dichloroanilino)-N-(2,6-difluorophenyl)acetamide is sourced from PubChem (CID 113180204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).