N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine

C10H10F3N5 — CID 114563336

IUPACN-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine
SMILESCNc1nc(-c2nccn2C)cc(C(F)(F)F)n1
InChIInChI=1S/C10H10F3N5/c1-14-9-16-6(8-15-3-4-18(8)2)5-7(17-9)10(11,12)13/h3-5H,1-2H3,(H,14,16,17)
InChIKeyCHNRBILVGLETJE-UHFFFAOYSA-N
MW257.22 g/mol
LogP1.94
Rot. Bonds2

About N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine

N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine (PubChem CID 114563336) has the molecular formula C10H10F3N5 and a molecular weight of 257.22 g/mol. Its IUPAC name is N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine
PubChem CID114563336
Molecular FormulaC10H10F3N5
Molecular Weight257.22 g/mol
Exact Mass257.09
IUPAC NameN-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine
SMILESCNc1nc(-c2nccn2C)cc(C(F)(F)F)n1
InChIInChI=1S/C10H10F3N5/c1-14-9-16-6(8-15-3-4-18(8)2)5-7(17-9)10(11,12)13/h3-5H,1-2H3,(H,14,16,17)
InChIKeyCHNRBILVGLETJE-UHFFFAOYSA-N
XLogP1.94
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.22
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-4-(3-methyl-4-pyridinyl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 114563377
4-(2,6-difluoro-3-methylphenyl)-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine
CID 114563489
N-methyl-4-(4-propan-2-ylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 114563283
4-butyl-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine
CID 106659304
4-(2,5-dichlorophenyl)-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine
CID 114563203
5-ethyl-4-(1-methylimidazol-2-yl)-2-(trifluoromethyl)pyridine
CID 68761140
4-(2,3-dichlorophenyl)-N-methyl-6-(trifluoromethyl)pyrimidin-2-amine
CID 114563172
N-methyl-4-(trifluoromethyl)-6-[3-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-amine
CID 114566081
N-methyl-4-(2,2,2-trifluoroethoxy)-6-(trifluoromethyl)pyrimidin-2-amine
CID 114566189
N-methyl-4-(trifluoromethyl)-6-[4-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-amine
CID 114566111
1-methyl-2-(1-methylimidazol-4-yl)imidazole
CID 15897140
5-[2-(methylamino)-6-(trifluoromethyl)pyrimidin-4-yl]pyridine-3-carbonitrile
CID 114563422

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine?
The IUPAC name of N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine (CID 114563336) is N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine.
What is the SMILES notation for N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine?
The canonical SMILES for N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine is CNc1nc(-c2nccn2C)cc(C(F)(F)F)n1.
What is the InChIKey of N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine?
The InChIKey is CHNRBILVGLETJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N5/c1-14-9-16-6(8-15-3-4-18(8)2)5-7(17-9)10(11,12)13/h3-5H,1-2H3,(H,14,16,17).
What are the key properties of N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine?
N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine has a molecular weight of 257.22 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(1-methylimidazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine is sourced from PubChem (CID 114563336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).