2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide

C16H22F3N3O2 — CID 32915177

IUPAC2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNc1ccc(NC(C)=O)cc1C(F)(F)F
InChIInChI=1S/C16H22F3N3O2/c1-5-15(3,4)22-14(24)9-20-13-7-6-11(21-10(2)23)8-12(13)16(17,18)19/h6-8,20H,5,9H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyVGZUFTXYOSIRTI-UHFFFAOYSA-N
MW345.37 g/mol
LogP3.38
Rot. Bonds6

About 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide

2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide (PubChem CID 32915177) has the molecular formula C16H22F3N3O2 and a molecular weight of 345.37 g/mol. Its IUPAC name is 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide
PubChem CID32915177
Molecular FormulaC16H22F3N3O2
Molecular Weight345.37 g/mol
Exact Mass345.17
IUPAC Name2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNc1ccc(NC(C)=O)cc1C(F)(F)F
InChIInChI=1S/C16H22F3N3O2/c1-5-15(3,4)22-14(24)9-20-13-7-6-11(21-10(2)23)8-12(13)16(17,18)19/h6-8,20H,5,9H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyVGZUFTXYOSIRTI-UHFFFAOYSA-N
XLogP3.38
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.37
LogP ≤ 53.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(4-bromophenyl)acetamide
CID 31418044
2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(3-fluorophenyl)acetamide
CID 31418097
2-[4-(2-hydroxyethoxy)-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide
CID 111111172
2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(4-methoxy-2-nitrophenyl)acetamide
CID 37175471
2-(4-fluoroanilino)-N-(2-methylbutan-2-yl)acetamide
CID 60671142
1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(2-methylbutan-2-ylamino)phenyl]urea
CID 71038616
N-[4-[(4-bromo-2-fluorophenyl)methylamino]-3-(trifluoromethyl)phenyl]acetamide
CID 46604266
N-[4-[[2-[(1-cyano-1-cyclopropylethyl)amino]-2-oxoethyl]amino]-3-(trifluoromethyl)phenyl]-4-fluorobenzamide
CID 60537249
tert-butyl N-[4-acetamido-3-(trifluoromethyl)phenyl]carbamate
CID 56827231
(2R)-N-[4-acetamido-2-(trifluoromethyl)phenyl]-2-aminopropanamide
CID 78973301
2-(3-fluoro-4-methylanilino)-N-(2-methylbutan-2-yl)acetamide
CID 60672268
N-[4-acetamido-2-(trifluoromethyl)phenyl]-4-(2,2,2-trifluoroethyl)-1,4-diazepane-1-carboxamide
CID 112825354

Frequently Asked Questions

What is the IUPAC name of 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide (CID 32915177) is 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide is CCC(C)(C)NC(=O)CNc1ccc(NC(C)=O)cc1C(F)(F)F.
What is the InChIKey of 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is VGZUFTXYOSIRTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22F3N3O2/c1-5-15(3,4)22-14(24)9-20-13-7-6-11(21-10(2)23)8-12(13)16(17,18)19/h6-8,20H,5,9H2,1-4H3,(H,21,23)(H,22,24).
What are the key properties of 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide?
2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 345.37 g/mol, XLogP of 3.38, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 32915177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).