[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone

C14H14N4O2 — CID 122249628

IUPAC[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone
SMILESCc1cccc(OC2CN(C(=O)c3cnccn3)C2)n1
InChIInChI=1S/C14H14N4O2/c1-10-3-2-4-13(17-10)20-11-8-18(9-11)14(19)12-7-15-5-6-16-12/h2-7,11H,8-9H2,1H3
InChIKeyKXWGTLRBUNIMSF-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.08
Rot. Bonds3

About [3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone

[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone (PubChem CID 122249628) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is [3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone.

Molecular Properties

Compound Name[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone
PubChem CID122249628
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC Name[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone
SMILESCc1cccc(OC2CN(C(=O)c3cnccn3)C2)n1
InChIInChI=1S/C14H14N4O2/c1-10-3-2-4-13(17-10)20-11-8-18(9-11)14(19)12-7-15-5-6-16-12/h2-7,11H,8-9H2,1H3
InChIKeyKXWGTLRBUNIMSF-UHFFFAOYSA-N
XLogP1.08
TPSA68.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]ethanone
CID 122249452
(2,6-difluorophenyl)-[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]methanone
CID 122249513
[3-(2-methylpyrimidin-4-yl)oxypiperidin-1-yl]-pyrazin-2-ylmethanone
CID 122260865
(3-methylphenyl)-[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]methanone
CID 122249483
5-[3-[(6-methyl-2-pyridinyl)oxy]azetidine-1-carbonyl]-1H-pyridin-2-one
CID 122249403
1-[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]butan-1-one
CID 122249453
3-[(6-methyl-2-pyridinyl)oxy]-N-propan-2-ylazetidine-1-carboxamide
CID 122249708
1-[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-2-propylpentan-1-one
CID 122249461
4-bromo-1-[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]butan-1-one
CID 122249599
2-(4-methoxyphenoxy)-1-[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]ethanone
CID 122249548
2-methyl-6-(1-pyridin-3-ylsulfonylazetidin-3-yl)oxypyridine
CID 122249733
2-(2-methylphenoxy)-1-[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]ethanone
CID 122249550

Frequently Asked Questions

What is the IUPAC name of [3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone?
The IUPAC name of [3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone (CID 122249628) is [3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone.
What is the SMILES notation for [3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone?
The canonical SMILES for [3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone is Cc1cccc(OC2CN(C(=O)c3cnccn3)C2)n1.
What is the InChIKey of [3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone?
The InChIKey is KXWGTLRBUNIMSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c1-10-3-2-4-13(17-10)20-11-8-18(9-11)14(19)12-7-15-5-6-16-12/h2-7,11H,8-9H2,1H3.
What are the key properties of [3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone?
[3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone has a molecular weight of 270.29 g/mol, XLogP of 1.08, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(6-methyl-2-pyridinyl)oxy]azetidin-1-yl]-pyrazin-2-ylmethanone is sourced from PubChem (CID 122249628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).