N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine

C10H8F3N5 — CID 155823149

IUPACN-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine
SMILESFC(F)(F)c1cc(NCc2cnccn2)ncn1
InChIInChI=1S/C10H8F3N5/c11-10(12,13)8-3-9(18-6-17-8)16-5-7-4-14-1-2-15-7/h1-4,6H,5H2,(H,16,17,18)
InChIKeyZMWZOASDWIEZPH-UHFFFAOYSA-N
MW255.20 g/mol
LogP1.90
Rot. Bonds3

About N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine

N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine (PubChem CID 155823149) has the molecular formula C10H8F3N5 and a molecular weight of 255.20 g/mol. Its IUPAC name is N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine
PubChem CID155823149
Molecular FormulaC10H8F3N5
Molecular Weight255.20 g/mol
Exact Mass255.07
IUPAC NameN-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine
SMILESFC(F)(F)c1cc(NCc2cnccn2)ncn1
InChIInChI=1S/C10H8F3N5/c11-10(12,13)8-3-9(18-6-17-8)16-5-7-4-14-1-2-15-7/h1-4,6H,5H2,(H,16,17,18)
InChIKeyZMWZOASDWIEZPH-UHFFFAOYSA-N
XLogP1.90
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.20
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-bromoethyl)-6-(trifluoromethyl)pyrimidin-4-amine
CID 126849106
N-(pyrazin-2-ylmethyl)-2-(trifluoromethyl)aniline
CID 55110167
6-chloro-N-[[4-(pyrazin-2-ylmethyl)phenyl]methyl]pyrimidin-4-amine
CID 171090415
2-(1,1,2,2,2-pentafluoroethyl)-N-(pyrazin-2-ylmethyl)aniline
CID 167903059
3-ethyl-N-[6-(trifluoromethyl)pyrimidin-4-yl]-1,2-dihydro-1,6-naphthyridin-7-amine
CID 156640988
4-fluoro-2-methyl-N-(pyrazin-2-ylmethyl)aniline
CID 62761968
2,2-difluoro-N-(pyrazin-2-ylmethyl)ethanamine
CID 115405977
1-N-ethyl-4-N-(pyrazin-2-ylmethyl)benzene-1,4-diamine
CID 83962412
N-(pyrazin-2-ylmethyl)-3-(2,2,2-trifluoro-1-methoxyethyl)aniline
CID 167847125
N-[1-(pyridin-3-ylmethyl)piperidin-4-yl]-6-(trifluoromethyl)pyrimidin-4-amine
CID 126876394
N-(pyrazin-2-ylmethyl)-1-[4-(trifluoromethyl)phenyl]ethanamine
CID 62763608
2-(iodomethyl)pyrazine
CID 21189711

Frequently Asked Questions

What is the IUPAC name of N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine?
The IUPAC name of N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine (CID 155823149) is N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine.
What is the SMILES notation for N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine?
The canonical SMILES for N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine is FC(F)(F)c1cc(NCc2cnccn2)ncn1.
What is the InChIKey of N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine?
The InChIKey is ZMWZOASDWIEZPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3N5/c11-10(12,13)8-3-9(18-6-17-8)16-5-7-4-14-1-2-15-7/h1-4,6H,5H2,(H,16,17,18).
What are the key properties of N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine?
N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine has a molecular weight of 255.20 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrazin-2-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine is sourced from PubChem (CID 155823149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).