2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide

C17H19FN2O — CID 9079711

IUPAC2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide
SMILESCc1ccc(C)c(NCC(=O)Nc2ccc(C)c(F)c2)c1
InChIInChI=1S/C17H19FN2O/c1-11-4-5-13(3)16(8-11)19-10-17(21)20-14-7-6-12(2)15(18)9-14/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyYTDRDQQYFZAVBO-UHFFFAOYSA-N
MW286.35 g/mol
LogP3.80
Rot. Bonds4

About 2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide

2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide (PubChem CID 9079711) has the molecular formula C17H19FN2O and a molecular weight of 286.35 g/mol. Its IUPAC name is 2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide
PubChem CID9079711
Molecular FormulaC17H19FN2O
Molecular Weight286.35 g/mol
Exact Mass286.15
IUPAC Name2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide
SMILESCc1ccc(C)c(NCC(=O)Nc2ccc(C)c(F)c2)c1
InChIInChI=1S/C17H19FN2O/c1-11-4-5-13(3)16(8-11)19-10-17(21)20-14-7-6-12(2)15(18)9-14/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyYTDRDQQYFZAVBO-UHFFFAOYSA-N
XLogP3.80
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-chloro-2-methylanilino)-N-(3,4-difluorophenyl)acetamide
CID 9102939
2-[5-(diethylsulfamoyl)-2-methylanilino]-N-(3-fluoro-4-methylphenyl)acetamide
CID 9100235
2-(5-fluoro-2-methylanilino)-N-(4-fluorophenyl)acetamide
CID 9099732
N-[3-[[2-(2,5-dimethylanilino)acetyl]amino]phenyl]-2,2-dimethylpropanamide
CID 54812945
2-[[2-(3-fluoro-4-methylanilino)-2-oxoethyl]amino]-N-methylbenzamide
CID 26543586
2-(ethylamino)-N-(3-fluoro-4-methylphenyl)acetamide
CID 60641239
2-(2,5-dimethylanilino)-N-(2,4,6-trimethylphenyl)acetamide
CID 26415868
2-[[2-(3-fluoro-4-methylanilino)-2-oxoethyl]amino]-N-(4-fluorophenyl)benzamide
CID 9104019
N-(4-methylphenyl)-2-(2,4,5-trifluoroanilino)acetamide
CID 62816420
2-(2-fluoro-4-methylanilino)-N-(4-methyl-3-nitrophenyl)acetamide
CID 26438397
2-azido-N-(3-fluoro-4-methylphenyl)acetamide
CID 52940377
N-(2-chloro-4-fluorophenyl)-2-(2,5-dimethylanilino)acetamide
CID 9079599

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide?
The IUPAC name of 2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide (CID 9079711) is 2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide?
The canonical SMILES for 2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide is Cc1ccc(C)c(NCC(=O)Nc2ccc(C)c(F)c2)c1.
What is the InChIKey of 2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide?
The InChIKey is YTDRDQQYFZAVBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O/c1-11-4-5-13(3)16(8-11)19-10-17(21)20-14-7-6-12(2)15(18)9-14/h4-9,19H,10H2,1-3H3,(H,20,21).
What are the key properties of 2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide?
2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide has a molecular weight of 286.35 g/mol, XLogP of 3.80, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide is sourced from PubChem (CID 9079711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).