2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine

C12H11F3N6O — CID 170109277

IUPAC2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine
SMILESCOCc1cn2c(Nc3ccn[nH]3)nc(C(F)(F)F)cc2n1
InChIInChI=1S/C12H11F3N6O/c1-22-6-7-5-21-10(17-7)4-8(12(13,14)15)18-11(21)19-9-2-3-16-20-9/h2-5H,6H2,1H3,(H2,16,18,19,20)
InChIKeyNWXCZTRNNAALQY-UHFFFAOYSA-N
MW312.26 g/mol
LogP2.36
Rot. Bonds4

About 2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine

2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine (PubChem CID 170109277) has the molecular formula C12H11F3N6O and a molecular weight of 312.26 g/mol. Its IUPAC name is 2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine
PubChem CID170109277
Molecular FormulaC12H11F3N6O
Molecular Weight312.26 g/mol
Exact Mass312.09
IUPAC Name2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine
SMILESCOCc1cn2c(Nc3ccn[nH]3)nc(C(F)(F)F)cc2n1
InChIInChI=1S/C12H11F3N6O/c1-22-6-7-5-21-10(17-7)4-8(12(13,14)15)18-11(21)19-9-2-3-16-20-9/h2-5H,6H2,1H3,(H2,16,18,19,20)
InChIKeyNWXCZTRNNAALQY-UHFFFAOYSA-N
XLogP2.36
TPSA80.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.26
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine?
The IUPAC name of 2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine (CID 170109277) is 2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine.
What is the SMILES notation for 2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine?
The canonical SMILES for 2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine is COCc1cn2c(Nc3ccn[nH]3)nc(C(F)(F)F)cc2n1.
What is the InChIKey of 2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine?
The InChIKey is NWXCZTRNNAALQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N6O/c1-22-6-7-5-21-10(17-7)4-8(12(13,14)15)18-11(21)19-9-2-3-16-20-9/h2-5H,6H2,1H3,(H2,16,18,19,20).
What are the key properties of 2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine?
2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine has a molecular weight of 312.26 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N-(1H-pyrazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-5-amine is sourced from PubChem (CID 170109277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).