5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one

C10H10F3N3O — CID 170628845

IUPAC5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one
SMILESCC1CNC(=O)N1c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C10H10F3N3O/c1-6-4-15-9(17)16(6)7-2-3-8(14-5-7)10(11,12)13/h2-3,5-6H,4H2,1H3,(H,15,17)
InChIKeyXNAZPUFYMXMACK-UHFFFAOYSA-N
MW245.20 g/mol
LogP2.02
Rot. Bonds1

About 5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one

5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one (PubChem CID 170628845) has the molecular formula C10H10F3N3O and a molecular weight of 245.20 g/mol. Its IUPAC name is 5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one.

Molecular Properties

Compound Name5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one
PubChem CID170628845
Molecular FormulaC10H10F3N3O
Molecular Weight245.20 g/mol
Exact Mass245.08
IUPAC Name5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one
SMILESCC1CNC(=O)N1c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C10H10F3N3O/c1-6-4-15-9(17)16(6)7-2-3-8(14-5-7)10(11,12)13/h2-3,5-6H,4H2,1H3,(H,15,17)
InChIKeyXNAZPUFYMXMACK-UHFFFAOYSA-N
XLogP2.02
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.20
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,6-dimethyl-1-[6-(trifluoromethyl)-3-pyridinyl]piperazine-2,5-dione
CID 82817505
(5S)-5-methyl-1-(4-methylphenyl)imidazolidin-2-one
CID 170628875
1-[6-(trifluoromethyl)-3-pyridinyl]-1,3-diazinan-2-one
CID 82817749
5-oxo-1-[6-(trifluoromethyl)-3-pyridinyl]pyrrolidine-2-carboxylic acid
CID 68755890
4-propan-2-yl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one
CID 86705189
(4S)-4-ethyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one
CID 140625322
(2S)-5-oxo-1-[6-(trifluoromethyl)-3-pyridinyl]pyrrolidine-2-carboxylic acid
CID 67456864
1-[6-(trifluoromethyl)-3-pyridinyl]-1,3-diazinane-2,4,6-trione
CID 112598156
3-propan-2-yl-1-[6-(trifluoromethyl)-3-pyridinyl]piperazine
CID 80505348
1-[6-(trifluoromethyl)-3-pyridinyl]-1,3-diazaspiro[4.5]decan-2-one
CID 150305620
(5R)-5-methyl-1-pyrimidin-4-ylimidazolidin-2-one
CID 170628889
3-propyl-1-[6-(trifluoromethyl)-3-pyridinyl]piperazine-2,5-dione
CID 82795304

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one?
The IUPAC name of 5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one (CID 170628845) is 5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one.
What is the SMILES notation for 5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one?
The canonical SMILES for 5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one is CC1CNC(=O)N1c1ccc(C(F)(F)F)nc1.
What is the InChIKey of 5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one?
The InChIKey is XNAZPUFYMXMACK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N3O/c1-6-4-15-9(17)16(6)7-2-3-8(14-5-7)10(11,12)13/h2-3,5-6H,4H2,1H3,(H,15,17).
What are the key properties of 5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one?
5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one has a molecular weight of 245.20 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-[6-(trifluoromethyl)-3-pyridinyl]imidazolidin-2-one is sourced from PubChem (CID 170628845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).