2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine

C10H16N2O — CID 129305119

IUPAC2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine
SMILESCC1CN=C(C2CCOCC2)C=N1
InChIInChI=1S/C10H16N2O/c1-8-6-12-10(7-11-8)9-2-4-13-5-3-9/h7-9H,2-6H2,1H3
InChIKeyLGTYXSAOSGRIGB-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.33
Rot. Bonds1

About 2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine

2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine (PubChem CID 129305119) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine.

Molecular Properties

Compound Name2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine
PubChem CID129305119
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine
SMILESCC1CN=C(C2CCOCC2)C=N1
InChIInChI=1S/C10H16N2O/c1-8-6-12-10(7-11-8)9-2-4-13-5-3-9/h7-9H,2-6H2,1H3
InChIKeyLGTYXSAOSGRIGB-UHFFFAOYSA-N
XLogP1.33
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-(oxan-4-yl)ethanimine
CID 66867748
3-methyl-N-(oxan-4-yl)butan-2-imine
CID 123654655
2-methyl-N-(oxan-4-yl)propan-1-imine
CID 123980513
N-ethyl-1-(oxan-4-yl)ethane-1,2-diimine
CID 130452359
N,N'-diethyl-1-(oxan-4-yl)ethane-1,2-diimine
CID 134221082

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine?
The IUPAC name of 2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine (CID 129305119) is 2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine.
What is the SMILES notation for 2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine?
The canonical SMILES for 2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine is CC1CN=C(C2CCOCC2)C=N1.
What is the InChIKey of 2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine?
The InChIKey is LGTYXSAOSGRIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-8-6-12-10(7-11-8)9-2-4-13-5-3-9/h7-9H,2-6H2,1H3.
What are the key properties of 2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine?
2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine has a molecular weight of 180.25 g/mol, XLogP of 1.33, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(oxan-4-yl)-2,3-dihydropyrazine is sourced from PubChem (CID 129305119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).