2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide

C18H16F2N2O3 — CID 113175525

IUPAC2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide
SMILESCC(=O)c1cccc(N(CC(=O)Nc2ccc(F)cc2F)C(C)=O)c1
InChIInChI=1S/C18H16F2N2O3/c1-11(23)13-4-3-5-15(8-13)22(12(2)24)10-18(25)21-17-7-6-14(19)9-16(17)20/h3-9H,10H2,1-2H3,(H,21,25)
InChIKeyCNHLZDNQJWNZKI-UHFFFAOYSA-N
MW346.33 g/mol
LogP3.16
Rot. Bonds5

About 2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide

2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide (PubChem CID 113175525) has the molecular formula C18H16F2N2O3 and a molecular weight of 346.33 g/mol. Its IUPAC name is 2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide
PubChem CID113175525
Molecular FormulaC18H16F2N2O3
Molecular Weight346.33 g/mol
Exact Mass346.11
IUPAC Name2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide
SMILESCC(=O)c1cccc(N(CC(=O)Nc2ccc(F)cc2F)C(C)=O)c1
InChIInChI=1S/C18H16F2N2O3/c1-11(23)13-4-3-5-15(8-13)22(12(2)24)10-18(25)21-17-7-6-14(19)9-16(17)20/h3-9H,10H2,1-2H3,(H,21,25)
InChIKeyCNHLZDNQJWNZKI-UHFFFAOYSA-N
XLogP3.16
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.33
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-acetylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113167233
2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113167823
2-(N-acetyl-4-ethylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113169375
2-(N-acetyl-2,4-difluoroanilino)-N-(2,4-difluorophenyl)acetamide
CID 113179083
2-[N-acetyl-4-(diethylamino)anilino]-N-(2,4-difluorophenyl)acetamide
CID 113176939
2-(N-acetyl-3-fluoroanilino)-N-(2,3,4-trifluorophenyl)acetamide
CID 113177755
2-(N,3-diacetylanilino)-N-phenylacetamide
CID 113175453
2-(N-acetyl-2-methylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113167429
3-(N-acetyl-3-bromoanilino)-N-(2,4-difluorophenyl)propanamide
CID 113132672
2-(N,3-diacetylanilino)-N-(3,4-dimethylphenyl)acetamide
CID 113175462
2-(N-acetyl-3-fluoroanilino)-N-(2,5-dichlorophenyl)acetamide
CID 113177743
2-(N,3-diacetylanilino)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 113175504

Frequently Asked Questions

What is the IUPAC name of 2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide?
The IUPAC name of 2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide (CID 113175525) is 2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide.
What is the SMILES notation for 2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide?
The canonical SMILES for 2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide is CC(=O)c1cccc(N(CC(=O)Nc2ccc(F)cc2F)C(C)=O)c1.
What is the InChIKey of 2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide?
The InChIKey is CNHLZDNQJWNZKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16F2N2O3/c1-11(23)13-4-3-5-15(8-13)22(12(2)24)10-18(25)21-17-7-6-14(19)9-16(17)20/h3-9H,10H2,1-2H3,(H,21,25).
What are the key properties of 2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide?
2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide has a molecular weight of 346.33 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide is sourced from PubChem (CID 113175525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).