N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane

C11H19N3 — CID 166460746

IUPACN,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane
SMILESC=C(C)n1cc(C)nc/c1=N\C.CC
InChIInChI=1S/C9H13N3.C2H6/c1-7(2)12-6-8(3)11-5-9(12)10-4;1-2/h5-6H,1H2,2-4H3;1-2H3/b10-9+;
InChIKeyWADZIRPIDMXHJQ-RRABGKBLSA-N
MW193.29 g/mol
LogP2.24
Rot. Bonds1

About N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane

N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane (PubChem CID 166460746) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane.

Molecular Properties

Compound NameN,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane
PubChem CID166460746
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane
SMILESC=C(C)n1cc(C)nc/c1=N\C.CC
InChIInChI=1S/C9H13N3.C2H6/c1-7(2)12-6-8(3)11-5-9(12)10-4;1-2/h5-6H,1H2,2-4H3;1-2H3/b10-9+;
InChIKeyWADZIRPIDMXHJQ-RRABGKBLSA-N
XLogP2.24
TPSA30.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane?
The IUPAC name of N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane (CID 166460746) is N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane.
What is the SMILES notation for N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane?
The canonical SMILES for N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane is C=C(C)n1cc(C)nc/c1=N\C.CC.
What is the InChIKey of N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane?
The InChIKey is WADZIRPIDMXHJQ-RRABGKBLSA-N. The full InChI is InChI=1S/C9H13N3.C2H6/c1-7(2)12-6-8(3)11-5-9(12)10-4;1-2/h5-6H,1H2,2-4H3;1-2H3/b10-9+;.
What are the key properties of N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane?
N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane has a molecular weight of 193.29 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-1-prop-1-en-2-ylpyrazin-2-imine;ethane is sourced from PubChem (CID 166460746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).