4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine

C8H10F3N3 — CID 82192734

IUPAC4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine
SMILESCC(C)c1cc(C(F)(F)F)nc(N)n1
InChIInChI=1S/C8H10F3N3/c1-4(2)5-3-6(8(9,10)11)14-7(12)13-5/h3-4H,1-2H3,(H2,12,13,14)
InChIKeyUIRICRATEJYHNY-UHFFFAOYSA-N
MW205.18 g/mol
LogP2.20
Rot. Bonds1

About 4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine

4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine (PubChem CID 82192734) has the molecular formula C8H10F3N3 and a molecular weight of 205.18 g/mol. Its IUPAC name is 4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine
PubChem CID82192734
Molecular FormulaC8H10F3N3
Molecular Weight205.18 g/mol
Exact Mass205.08
IUPAC Name4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine
SMILESCC(C)c1cc(C(F)(F)F)nc(N)n1
InChIInChI=1S/C8H10F3N3/c1-4(2)5-3-6(8(9,10)11)14-7(12)13-5/h3-4H,1-2H3,(H2,12,13,14)
InChIKeyUIRICRATEJYHNY-UHFFFAOYSA-N
XLogP2.20
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.18
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-propan-2-yl-4,6-bis(trifluoromethyl)pyridine
CID 59664272
6-propan-2-ylpyrimidine-2,4-diamine
CID 12655163
4-(4-propan-2-ylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 114563284
4-chloro-6-(trifluoromethyl)pyrimidin-2-amine
CID 13086907
1-[[2-amino-6-(trifluoromethyl)pyrimidin-4-yl]amino]propan-2-ol
CID 114564072
4-(4-fluorophenyl)-6-propan-2-ylpyrimidin-2-amine
CID 14545360
4-N-(5-methylhexan-2-yl)-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114565132
4-N-methyl-4-N-(4-methylpentan-2-yl)-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114564622
4-N-(1-methoxypropan-2-yl)-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114563868
(2-amino-6-propan-2-ylpyrimidin-4-yl)methanol
CID 68669560
(2S)-2-[[2-amino-6-(trifluoromethyl)pyrimidin-4-yl]amino]-3-methylbutan-1-ol
CID 114986067
3-[[2-amino-6-(trifluoromethyl)pyrimidin-4-yl]-methylamino]-2-methylpropanenitrile
CID 114564590

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine?
The IUPAC name of 4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine (CID 82192734) is 4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine.
What is the SMILES notation for 4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine?
The canonical SMILES for 4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine is CC(C)c1cc(C(F)(F)F)nc(N)n1.
What is the InChIKey of 4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine?
The InChIKey is UIRICRATEJYHNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3/c1-4(2)5-3-6(8(9,10)11)14-7(12)13-5/h3-4H,1-2H3,(H2,12,13,14).
What are the key properties of 4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine?
4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine has a molecular weight of 205.18 g/mol, XLogP of 2.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-amine is sourced from PubChem (CID 82192734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).