2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol

C11H17N3O2 — CID 142389277

IUPAC2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol
SMILESCc1cnc(OCC2CN(CCO)C2)cn1
InChIInChI=1S/C11H17N3O2/c1-9-4-13-11(5-12-9)16-8-10-6-14(7-10)2-3-15/h4-5,10,15H,2-3,6-8H2,1H3
InChIKeyJRWZIWACBJNKBO-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.09
Rot. Bonds5

About 2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol

2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol (PubChem CID 142389277) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol
PubChem CID142389277
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol
SMILESCc1cnc(OCC2CN(CCO)C2)cn1
InChIInChI=1S/C11H17N3O2/c1-9-4-13-11(5-12-9)16-8-10-6-14(7-10)2-3-15/h4-5,10,15H,2-3,6-8H2,1H3
InChIKeyJRWZIWACBJNKBO-UHFFFAOYSA-N
XLogP0.09
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol?
The IUPAC name of 2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol (CID 142389277) is 2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol.
What is the SMILES notation for 2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol?
The canonical SMILES for 2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol is Cc1cnc(OCC2CN(CCO)C2)cn1.
What is the InChIKey of 2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol?
The InChIKey is JRWZIWACBJNKBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-9-4-13-11(5-12-9)16-8-10-6-14(7-10)2-3-15/h4-5,10,15H,2-3,6-8H2,1H3.
What are the key properties of 2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol?
2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol has a molecular weight of 223.28 g/mol, XLogP of 0.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(5-methylpyrazin-2-yl)oxymethyl]azetidin-1-yl]ethanol is sourced from PubChem (CID 142389277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).