1-ethyl-3,5-dimethylpyrazin-2-imine

C8H13N3 — CID 163653575

IUPAC1-ethyl-3,5-dimethylpyrazin-2-imine
SMILES[H]/N=c1\c(C)nc(C)cn1CC
InChIInChI=1S/C8H13N3/c1-4-11-5-6(2)10-7(3)8(11)9/h5,9H,4H2,1-3H3/b9-8+
InChIKeyIOHHMDDTMHRKQX-CMDGGOBGSA-N
MW151.21 g/mol
LogP1.00
Rot. Bonds1

About 1-ethyl-3,5-dimethylpyrazin-2-imine

1-ethyl-3,5-dimethylpyrazin-2-imine (PubChem CID 163653575) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-ethyl-3,5-dimethylpyrazin-2-imine.

Molecular Properties

Compound Name1-ethyl-3,5-dimethylpyrazin-2-imine
PubChem CID163653575
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name1-ethyl-3,5-dimethylpyrazin-2-imine
SMILES[H]/N=c1\c(C)nc(C)cn1CC
InChIInChI=1S/C8H13N3/c1-4-11-5-6(2)10-7(3)8(11)9/h5,9H,4H2,1-3H3/b9-8+
InChIKeyIOHHMDDTMHRKQX-CMDGGOBGSA-N
XLogP1.00
TPSA41.67 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Bromo-3,5-dimethylpyrazin-2-imine
CID 139439126
1-Ethenyl-3,5-dimethylpyrazin-2-imine
CID 139439156
1-(1-Bromoethyl)-3,5-dimethylpyrazin-2-imine
CID 139439163
3,6-dimethyl-1-[(Z)-prop-1-enyl]pyrazin-2-imine
CID 141771488
N'-[(E)-2-aminoprop-1-enyl]-N-methyl-N-propylethanimidamide;ethane
CID 142097633
2-imino-N,N,3,6-tetramethylpyrazin-1-amine
CID 153671552
1,3,5-Trimethylpyrazin-2-imine
CID 155073800
1-Ethyl-5-methylpyrazin-2-imine
CID 166726546
1-Methanimidoyl-3,5-dimethylpyrazin-2-imine
CID 166773725
1-[(Z)-but-2-en-2-yl]-3-methylpyrazin-2-imine
CID 170269200
1-[(2S)-3-iodobutan-2-yl]-3,5-dimethylpyrazin-2-imine
CID 173821571
N-methyl-N-[(E)-1-(methylideneamino)prop-1-en-2-yl]ethanimidamide
CID 174329032

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3,5-dimethylpyrazin-2-imine?
The IUPAC name of 1-ethyl-3,5-dimethylpyrazin-2-imine (CID 163653575) is 1-ethyl-3,5-dimethylpyrazin-2-imine.
What is the SMILES notation for 1-ethyl-3,5-dimethylpyrazin-2-imine?
The canonical SMILES for 1-ethyl-3,5-dimethylpyrazin-2-imine is [H]/N=c1\c(C)nc(C)cn1CC.
What is the InChIKey of 1-ethyl-3,5-dimethylpyrazin-2-imine?
The InChIKey is IOHHMDDTMHRKQX-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H13N3/c1-4-11-5-6(2)10-7(3)8(11)9/h5,9H,4H2,1-3H3/b9-8+.
What are the key properties of 1-ethyl-3,5-dimethylpyrazin-2-imine?
1-ethyl-3,5-dimethylpyrazin-2-imine has a molecular weight of 151.21 g/mol, XLogP of 1.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3,5-dimethylpyrazin-2-imine is sourced from PubChem (CID 163653575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).