2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine

C17H12F3N7O — CID 118101407

IUPAC2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine
SMILESCOc1ncc(Nc2cncc(-c3c(C(F)(F)F)nc4ccccn34)n2)cn1
InChIInChI=1S/C17H12F3N7O/c1-28-16-22-6-10(7-23-16)24-12-9-21-8-11(25-12)14-15(17(18,19)20)26-13-4-2-3-5-27(13)14/h2-9H,1H3,(H,24,25)
InChIKeyZNFYFMWILQWFKX-UHFFFAOYSA-N
MW387.33 g/mol
LogP3.35
Rot. Bonds4

About 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine

2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine (PubChem CID 118101407) has the molecular formula C17H12F3N7O and a molecular weight of 387.33 g/mol. Its IUPAC name is 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine.

Molecular Properties

Compound Name2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine
PubChem CID118101407
Molecular FormulaC17H12F3N7O
Molecular Weight387.33 g/mol
Exact Mass387.11
IUPAC Name2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine
SMILESCOc1ncc(Nc2cncc(-c3c(C(F)(F)F)nc4ccccn34)n2)cn1
InChIInChI=1S/C17H12F3N7O/c1-28-16-22-6-10(7-23-16)24-12-9-21-8-11(25-12)14-15(17(18,19)20)26-13-4-2-3-5-27(13)14/h2-9H,1H3,(H,24,25)
InChIKeyZNFYFMWILQWFKX-UHFFFAOYSA-N
XLogP3.35
TPSA90.12 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.33
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine with MolForge

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Related Compounds

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CID 49970
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4-(7-((Dimethylamino)methyl)-2-(4-fluorophenyl)imidazo(1,2-a)pyridin-3-yl)pyrimidin-2-amine
CID 10133248
N2-[4-(4-methylpiperazin-1-yl)phenyl]-N8-phenyl-9-propan-2-yl-purine-2,8-diamine
CID 54759842
9-cyclopentyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N8-phenyl-purine-2,8-diamine
CID 54760383
9-cyclohexyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N8-phenyl-purine-2,8-diamine
CID 54761307
N-(3-fluoropyridin-4-yl)-2-[6-(trifluoromethyl)pyridin-2-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 126537450
N-cyclohexyl-4-(imidazo(1,2-a)pyridin-3-yl)-N-methylpyrimidin-2-amine
CID 24801862
2-(pyridin-2-yl)-1H-imidazo(4,5-c)pyridine
CID 947740

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine?
The IUPAC name of 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine (CID 118101407) is 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine.
What is the SMILES notation for 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine?
The canonical SMILES for 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine is COc1ncc(Nc2cncc(-c3c(C(F)(F)F)nc4ccccn34)n2)cn1.
What is the InChIKey of 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine?
The InChIKey is ZNFYFMWILQWFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12F3N7O/c1-28-16-22-6-10(7-23-16)24-12-9-21-8-11(25-12)14-15(17(18,19)20)26-13-4-2-3-5-27(13)14/h2-9H,1H3,(H,24,25).
What are the key properties of 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine?
2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine has a molecular weight of 387.33 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine is sourced from PubChem (CID 118101407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).