2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine

C18H17FN6 — CID 126557252

IUPAC2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCc1ncc(C)n2nc([C@@H]3CC3c3nc4cc(F)ccn4c3C)nc12
InChIInChI=1S/C18H17FN6/c1-9-8-20-10(2)18-22-17(23-25(9)18)14-7-13(14)16-11(3)24-5-4-12(19)6-15(24)21-16/h4-6,8,13-14H,7H2,1-3H3/t13?,14-/m1/s1
InChIKeyDPUAATSJCQHSRA-ARLHGKGLSA-N
MW336.37 g/mol
LogP3.11
Rot. Bonds2

About 2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine

2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine (PubChem CID 126557252) has the molecular formula C18H17FN6 and a molecular weight of 336.37 g/mol. Its IUPAC name is 2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine
PubChem CID126557252
Molecular FormulaC18H17FN6
Molecular Weight336.37 g/mol
Exact Mass336.15
IUPAC Name2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCc1ncc(C)n2nc([C@@H]3CC3c3nc4cc(F)ccn4c3C)nc12
InChIInChI=1S/C18H17FN6/c1-9-8-20-10(2)18-22-17(23-25(9)18)14-7-13(14)16-11(3)24-5-4-12(19)6-15(24)21-16/h4-6,8,13-14H,7H2,1-3H3/t13?,14-/m1/s1
InChIKeyDPUAATSJCQHSRA-ARLHGKGLSA-N
XLogP3.11
TPSA60.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine?
The IUPAC name of 2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine (CID 126557252) is 2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine.
What is the SMILES notation for 2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine?
The canonical SMILES for 2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine is Cc1ncc(C)n2nc([C@@H]3CC3c3nc4cc(F)ccn4c3C)nc12.
What is the InChIKey of 2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine?
The InChIKey is DPUAATSJCQHSRA-ARLHGKGLSA-N. The full InChI is InChI=1S/C18H17FN6/c1-9-8-20-10(2)18-22-17(23-25(9)18)14-7-13(14)16-11(3)24-5-4-12(19)6-15(24)21-16/h4-6,8,13-14H,7H2,1-3H3/t13?,14-/m1/s1.
What are the key properties of 2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine?
2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine has a molecular weight of 336.37 g/mol, XLogP of 3.11, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-2-(7-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine is sourced from PubChem (CID 126557252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).