1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine

C9H14N2 — CID 144550350

IUPAC1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine
SMILESC=CN1C=C(C)CC/C1=N\C
InChIInChI=1S/C9H14N2/c1-4-11-7-8(2)5-6-9(11)10-3/h4,7H,1,5-6H2,2-3H3/b10-9+
InChIKeyRAPZVFBHCLVAFZ-MDZDMXLPSA-N
MW150.22 g/mol
LogP2.16
Rot. Bonds1

About 1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine

1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine (PubChem CID 144550350) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine.

Molecular Properties

Compound Name1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine
PubChem CID144550350
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine
SMILESC=CN1C=C(C)CC/C1=N\C
InChIInChI=1S/C9H14N2/c1-4-11-7-8(2)5-6-9(11)10-3/h4,7H,1,5-6H2,2-3H3/b10-9+
InChIKeyRAPZVFBHCLVAFZ-MDZDMXLPSA-N
XLogP2.16
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine?
The IUPAC name of 1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine (CID 144550350) is 1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine.
What is the SMILES notation for 1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine?
The canonical SMILES for 1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine is C=CN1C=C(C)CC/C1=N\C.
What is the InChIKey of 1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine?
The InChIKey is RAPZVFBHCLVAFZ-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H14N2/c1-4-11-7-8(2)5-6-9(11)10-3/h4,7H,1,5-6H2,2-3H3/b10-9+.
What are the key properties of 1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine?
1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine has a molecular weight of 150.22 g/mol, XLogP of 2.16, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-N,5-dimethyl-3,4-dihydropyridin-2-imine is sourced from PubChem (CID 144550350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).