ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine

C10H21N3 — CID 142345217

IUPACethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine
SMILESCC.CC/N=C1\CN(C)C=C(C)N1
InChIInChI=1S/C8H15N3.C2H6/c1-4-9-8-6-11(3)5-7(2)10-8;1-2/h5H,4,6H2,1-3H3,(H,9,10);1-2H3
InChIKeyRVOVEEBIGQWKER-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.83
Rot. Bonds1

About ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine

ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine (PubChem CID 142345217) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine.

Molecular Properties

Compound Nameethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine
PubChem CID142345217
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Nameethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine
SMILESCC.CC/N=C1\CN(C)C=C(C)N1
InChIInChI=1S/C8H15N3.C2H6/c1-4-9-8-6-11(3)5-7(2)10-8;1-2/h5H,4,6H2,1-3H3,(H,9,10);1-2H3
InChIKeyRVOVEEBIGQWKER-UHFFFAOYSA-N
XLogP1.83
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine?
The IUPAC name of ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine (CID 142345217) is ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine.
What is the SMILES notation for ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine?
The canonical SMILES for ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine is CC.CC/N=C1\CN(C)C=C(C)N1.
What is the InChIKey of ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine?
The InChIKey is RVOVEEBIGQWKER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3.C2H6/c1-4-9-8-6-11(3)5-7(2)10-8;1-2/h5H,4,6H2,1-3H3,(H,9,10);1-2H3.
What are the key properties of ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine?
ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine has a molecular weight of 183.30 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-4,6-dimethyl-1,3-dihydropyrazin-2-imine is sourced from PubChem (CID 142345217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).