2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide

C16H16F2N2O — CID 31667661

IUPAC2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide
SMILESCc1ccc(F)cc1NCC(=O)NCc1ccccc1F
InChIInChI=1S/C16H16F2N2O/c1-11-6-7-13(17)8-15(11)19-10-16(21)20-9-12-4-2-3-5-14(12)18/h2-8,19H,9-10H2,1H3,(H,20,21)
InChIKeyFBQXAQJDWQCTAH-UHFFFAOYSA-N
MW290.31 g/mol
LogP3.00
Rot. Bonds5

About 2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide

2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide (PubChem CID 31667661) has the molecular formula C16H16F2N2O and a molecular weight of 290.31 g/mol. Its IUPAC name is 2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide
PubChem CID31667661
Molecular FormulaC16H16F2N2O
Molecular Weight290.31 g/mol
Exact Mass290.12
IUPAC Name2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide
SMILESCc1ccc(F)cc1NCC(=O)NCc1ccccc1F
InChIInChI=1S/C16H16F2N2O/c1-11-6-7-13(17)8-15(11)19-10-16(21)20-9-12-4-2-3-5-14(12)18/h2-8,19H,9-10H2,1H3,(H,20,21)
InChIKeyFBQXAQJDWQCTAH-UHFFFAOYSA-N
XLogP3.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.31
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-difluoroanilino)-N-[(2-methylphenyl)methyl]acetamide
CID 108996706
N-[(4-chlorophenyl)methyl]-2-(5-fluoro-2-methylanilino)acetamide
CID 26437770
2-(3-fluoroanilino)-N-[(2-fluorophenyl)methyl]acetamide
CID 31665741
2-(3,5-dimethylanilino)-N-[(2-fluorophenyl)methyl]acetamide
CID 51225001
2-(5-fluoro-2-methylanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60652978
2-(5-fluoro-2-methylanilino)-N-(4-fluorophenyl)acetamide
CID 9099732
2-acetamido-N-[(2-fluorophenyl)methyl]acetamide
CID 110686999
2-(2-fluorophenyl)-N-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]acetamide
CID 112992093
2-(5-chloro-2-methylanilino)-N-(2,5-difluorophenyl)acetamide
CID 37479978
2-methyl-N-[4-methyl-3-[[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]phenyl]propanamide
CID 60537469
3-(4-chloro-2-methylanilino)-N-[(2-fluorophenyl)methyl]propanamide
CID 109020765
2-(5-acetamido-2-methoxyanilino)-N-[(2-fluorophenyl)methyl]acetamide
CID 31673267

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide?
The IUPAC name of 2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide (CID 31667661) is 2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide.
What is the SMILES notation for 2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide?
The canonical SMILES for 2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide is Cc1ccc(F)cc1NCC(=O)NCc1ccccc1F.
What is the InChIKey of 2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide?
The InChIKey is FBQXAQJDWQCTAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2N2O/c1-11-6-7-13(17)8-15(11)19-10-16(21)20-9-12-4-2-3-5-14(12)18/h2-8,19H,9-10H2,1H3,(H,20,21).
What are the key properties of 2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide?
2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide has a molecular weight of 290.31 g/mol, XLogP of 3.00, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-methylanilino)-N-[(2-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 31667661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).