N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide

C18H19F3N4O2 — CID 4885137

IUPACN-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide
SMILESCCN(CC(=O)Nc1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C18H19F3N4O2/c1-3-25(16-9-4-13(10-22-16)18(19,20)21)11-17(27)24-15-7-5-14(6-8-15)23-12(2)26/h4-10H,3,11H2,1-2H3,(H,23,26)(H,24,27)
InChIKeyDKRODAGUGRTBFE-UHFFFAOYSA-N
MW380.37 g/mol
LogP3.52
Rot. Bonds6

About N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide

N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide (PubChem CID 4885137) has the molecular formula C18H19F3N4O2 and a molecular weight of 380.37 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide
PubChem CID4885137
Molecular FormulaC18H19F3N4O2
Molecular Weight380.37 g/mol
Exact Mass380.15
IUPAC NameN-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide
SMILESCCN(CC(=O)Nc1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C18H19F3N4O2/c1-3-25(16-9-4-13(10-22-16)18(19,20)21)11-17(27)24-15-7-5-14(6-8-15)23-12(2)26/h4-10H,3,11H2,1-2H3,(H,23,26)(H,24,27)
InChIKeyDKRODAGUGRTBFE-UHFFFAOYSA-N
XLogP3.52
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.37
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-Difluorophenyl)-4-(2-pyridinyl)-1-piperazineacetamide
CID 3547487
2-[3-(2,2-Difluoro-2-pyridin-2-yl-ethylamino)-6-methyl-2-oxo-2H-pyrazin-1-yl]-N-(3-fluoro-4-methyl-pyridin-2-ylmethyl)-acetamide
CID 447221
1-(3-Methyl-pyridin-2-YL)-3-phenyl-urea
CID 790718
L-375378
CID 154118
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-[6-methyl-2-oxo-3-(2-pyridin-3-yl-ethylamino)-2H-pyrazin-1-yl]-acetamide
CID 10884041
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-[6-methyl-2-oxo-3-(2-pyridin-2-yl-ethylamino)-2H-pyrazin-1-yl]-acetamide
CID 11004075
N-((6-amino-2-methylpyridin-3-yl)methyl)-2-(3-(2,2-difluoro-2-phenylethylamino)-6-methyl-2-oxopyrazin-1(2H)-yl)acetamide
CID 11762017
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-[6-methyl-3-((R)-1-methyl-2-phenyl-ethylamino)-2-oxo-2H-pyrazin-1-yl]-acetamide
CID 11796404
2-Acetylamino-3,3,3-trifluoro-2-(5-methyl-pyridin-2-ylamino)-propionic acid methyl ester
CID 609233
N-(4-methylphenyl)-4-[3-(trifluoromethyl)pyridin-2-yl]tetrahydropyrazine-1(2H)-carboxamide
CID 2741741
N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 4595252
1-(4-Fluorophenyl)-3-(5-methylpyridin-2-yl)urea
CID 701006

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide (CID 4885137) is N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide is CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cn1.
What is the InChIKey of N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide?
The InChIKey is DKRODAGUGRTBFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F3N4O2/c1-3-25(16-9-4-13(10-22-16)18(19,20)21)11-17(27)24-15-7-5-14(6-8-15)23-12(2)26/h4-10H,3,11H2,1-2H3,(H,23,26)(H,24,27).
What are the key properties of N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide?
N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide has a molecular weight of 380.37 g/mol, XLogP of 3.52, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-[ethyl-[5-(trifluoromethyl)-2-pyridinyl]amino]acetamide is sourced from PubChem (CID 4885137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).