2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide

C15H14F3N3O2 — CID 138025671

IUPAC2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide
SMILESCOC(C(=O)Nc1cnc(C)nc1)c1ccccc1C(F)(F)F
InChIInChI=1S/C15H14F3N3O2/c1-9-19-7-10(8-20-9)21-14(22)13(23-2)11-5-3-4-6-12(11)15(16,17)18/h3-8,13H,1-2H3,(H,21,22)
InChIKeySGFLESUUINRKET-UHFFFAOYSA-N
MW325.29 g/mol
LogP3.13
Rot. Bonds4

About 2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide

2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide (PubChem CID 138025671) has the molecular formula C15H14F3N3O2 and a molecular weight of 325.29 g/mol. Its IUPAC name is 2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide
PubChem CID138025671
Molecular FormulaC15H14F3N3O2
Molecular Weight325.29 g/mol
Exact Mass325.10
IUPAC Name2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide
SMILESCOC(C(=O)Nc1cnc(C)nc1)c1ccccc1C(F)(F)F
InChIInChI=1S/C15H14F3N3O2/c1-9-19-7-10(8-20-9)21-14(22)13(23-2)11-5-3-4-6-12(11)15(16,17)18/h3-8,13H,1-2H3,(H,21,22)
InChIKeySGFLESUUINRKET-UHFFFAOYSA-N
XLogP3.13
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.29
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-(pyrimidin-2-ylmethyl)-2-[2-(trifluoromethyl)phenyl]acetamide
CID 136564651
N-(1H-imidazol-5-ylmethyl)-2-methoxy-2-[2-(trifluoromethyl)phenyl]acetamide
CID 136563984
1-[hydroperoxy(methoxy)methyl]-2-(trifluoromethyl)benzene
CID 14783520
2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide
CID 113225450
1-[2-methoxy-2-(2-methylphenyl)ethyl]-3-[2-(trifluoromethyl)phenyl]urea
CID 71810588
6-methoxy-N-[1-[2-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine
CID 43093893
1-(6,7-dihydro-5H-tetrazolo[1,5-a]pyrimidin-4-yl)-2-methoxy-2-[2-(trifluoromethyl)phenyl]ethanone
CID 138051228
2-bromo-N-(2-methylpyrimidin-5-yl)propanamide
CID 131183260
1-[(3S,4S)-3-hydroxy-4-methoxypyrrolidin-1-yl]-2-methoxy-2-[2-(trifluoromethyl)phenyl]ethanone
CID 164641226
(2S)-2-methoxy-2-phenyl-N'-[2-(trifluoromethyl)phenyl]acetohydrazide
CID 96517757
2-methoxy-1-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-2-[2-(trifluoromethyl)phenyl]ethanone
CID 138027459
2-amino-3-methyl-N-(2-methylpyrimidin-5-yl)butanamide
CID 119317714

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide (CID 138025671) is 2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide is COC(C(=O)Nc1cnc(C)nc1)c1ccccc1C(F)(F)F.
What is the InChIKey of 2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is SGFLESUUINRKET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3N3O2/c1-9-19-7-10(8-20-9)21-14(22)13(23-2)11-5-3-4-6-12(11)15(16,17)18/h3-8,13H,1-2H3,(H,21,22).
What are the key properties of 2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide?
2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 325.29 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2-methylpyrimidin-5-yl)-2-[2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 138025671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).