N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide

C15H13Cl2FN2O — CID 9100051

IUPACN-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide
SMILESCc1ccc(NCC(=O)Nc2cccc(Cl)c2Cl)cc1F
InChIInChI=1S/C15H13Cl2FN2O/c1-9-5-6-10(7-12(9)18)19-8-14(21)20-13-4-2-3-11(16)15(13)17/h2-7,19H,8H2,1H3,(H,20,21)
InChIKeyKRLYWAGDDJTBEY-UHFFFAOYSA-N
MW327.19 g/mol
LogP4.49
Rot. Bonds4

About N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide

N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide (PubChem CID 9100051) has the molecular formula C15H13Cl2FN2O and a molecular weight of 327.19 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide
PubChem CID9100051
Molecular FormulaC15H13Cl2FN2O
Molecular Weight327.19 g/mol
Exact Mass326.04
IUPAC NameN-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide
SMILESCc1ccc(NCC(=O)Nc2cccc(Cl)c2Cl)cc1F
InChIInChI=1S/C15H13Cl2FN2O/c1-9-5-6-10(7-12(9)18)19-8-14(21)20-13-4-2-3-11(16)15(13)17/h2-7,19H,8H2,1H3,(H,20,21)
InChIKeyKRLYWAGDDJTBEY-UHFFFAOYSA-N
XLogP4.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.19
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[5-[[2-(2,3-dichloroanilino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
CID 54844937
2-(4-chloroanilino)-N-(2,3-dichlorophenyl)acetamide
CID 26417216
2-(5-acetamido-2-fluoroanilino)-N-(2,3-dichlorophenyl)acetamide
CID 37278206
2-(4-acetamidoanilino)-N-(2,3-dichlorophenyl)acetamide
CID 54808241
N-(2,3-dichlorophenyl)-2-[4-(dimethylamino)anilino]acetamide
CID 109010323
N-(3-chloro-4-fluorophenyl)-2-(2,3-dichloroanilino)acetamide
CID 54815845
methyl 3-[[2-(2,3-dichloroanilino)-2-oxoethyl]amino]benzoate
CID 34067227
N-(2,3-dichlorophenyl)-2-(3-ethynylanilino)acetamide
CID 31418197
2-[[2-(3-fluoro-4-methylanilino)acetyl]amino]-N-phenylbenzamide
CID 26438041
N-(2-benzoylphenyl)-2-(3-fluoro-4-methylanilino)acetamide
CID 8830519
N-(2,3-dichlorophenyl)-2-[3-(difluoromethoxy)-4-methoxyanilino]acetamide
CID 31418500
N-(2,3-dichlorophenyl)-2-[4-(diethylamino)anilino]acetamide
CID 109010402

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide (CID 9100051) is N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide is Cc1ccc(NCC(=O)Nc2cccc(Cl)c2Cl)cc1F.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide?
The InChIKey is KRLYWAGDDJTBEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FN2O/c1-9-5-6-10(7-12(9)18)19-8-14(21)20-13-4-2-3-11(16)15(13)17/h2-7,19H,8H2,1H3,(H,20,21).
What are the key properties of N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide?
N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide has a molecular weight of 327.19 g/mol, XLogP of 4.49, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-(3-fluoro-4-methylanilino)acetamide is sourced from PubChem (CID 9100051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).