4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine

C11H14F3N3 — CID 63317304

IUPAC4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine
SMILESCc1cc(C(F)(F)F)nc(C2CCCCN2)n1
InChIInChI=1S/C11H14F3N3/c1-7-6-9(11(12,13)14)17-10(16-7)8-4-2-3-5-15-8/h6,8,15H,2-5H2,1H3
InChIKeyYKIXMXKBFYOTNG-UHFFFAOYSA-N
MW245.25 g/mol
LogP2.62
Rot. Bonds1

About 4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine

4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine (PubChem CID 63317304) has the molecular formula C11H14F3N3 and a molecular weight of 245.25 g/mol. Its IUPAC name is 4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine.

Molecular Properties

Compound Name4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine
PubChem CID63317304
Molecular FormulaC11H14F3N3
Molecular Weight245.25 g/mol
Exact Mass245.11
IUPAC Name4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine
SMILESCc1cc(C(F)(F)F)nc(C2CCCCN2)n1
InChIInChI=1S/C11H14F3N3/c1-7-6-9(11(12,13)14)17-10(16-7)8-4-2-3-5-15-8/h6,8,15H,2-5H2,1H3
InChIKeyYKIXMXKBFYOTNG-UHFFFAOYSA-N
XLogP2.62
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.25
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-Dimethyl-6-(piperazin-1-yl)pyrimidine
CID 4778269
4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6-(3,3,3-trifluoropropyl)pyrimidin-2-amine
CID 53378928
1-(4,6-Dimethyl-2-pyrimidyl)piperazine
CID 2758651
4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6-(2,2,2-trifluoroethyl)pyrimidin-2-amine
CID 118720437
N-Cyclohexyl-N'-(4,6-dimethyl-pyrimidin-2-yl)-guanidine
CID 579759
4,6-dimethyl-N-(octahydro-2H-benzimidazol-2-ylidene)pyrimidin-2-amine
CID 2945459
2-(Ethylamino)-4-methyl-6-(trifluoromethyl)pyrimidine
CID 3704748
1-(2,6-Dimethylpyrimidin-4-yl)piperidin-4-amine
CID 4728071
6-(trans-3-aminocyclobutyl)-N~4~-{2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl}pyrimidine-2,4-diamine
CID 91760808
2-N-cyclohexyl-4-N-[2-(dimethylamino)ethyl]-6-methylpyrimidine-2,4-diamine
CID 112910508
N-(4,5-dihydro-1H-imidazol-2-yl)-4,6-dimethylpyrimidin-2-amine
CID 795372
N-(4,6-dimethylpyrimidin-2-yl)piperidine-1-carboximidamide
CID 5728930

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine?
The IUPAC name of 4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine (CID 63317304) is 4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine.
What is the SMILES notation for 4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine?
The canonical SMILES for 4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine is Cc1cc(C(F)(F)F)nc(C2CCCCN2)n1.
What is the InChIKey of 4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine?
The InChIKey is YKIXMXKBFYOTNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3/c1-7-6-9(11(12,13)14)17-10(16-7)8-4-2-3-5-15-8/h6,8,15H,2-5H2,1H3.
What are the key properties of 4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine?
4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine has a molecular weight of 245.25 g/mol, XLogP of 2.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-piperidin-2-yl-6-(trifluoromethyl)pyrimidine is sourced from PubChem (CID 63317304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).