2-(2,3-dihydropyridin-6-yl)ethanimine

C7H10N2 — CID 90964112

IUPAC2-(2,3-dihydropyridin-6-yl)ethanimine
SMILES[H]/N=C/CC1=NCCC=C1
InChIInChI=1S/C7H10N2/c8-5-4-7-3-1-2-6-9-7/h1,3,5,8H,2,4,6H2/b8-5+
InChIKeyVEGIVRREVASCSM-VMPITWQZSA-N
MW122.17 g/mol
LogP1.43
Rot. Bonds2

About 2-(2,3-dihydropyridin-6-yl)ethanimine

2-(2,3-dihydropyridin-6-yl)ethanimine (PubChem CID 90964112) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 2-(2,3-dihydropyridin-6-yl)ethanimine.

Molecular Properties

Compound Name2-(2,3-dihydropyridin-6-yl)ethanimine
PubChem CID90964112
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name2-(2,3-dihydropyridin-6-yl)ethanimine
SMILES[H]/N=C/CC1=NCCC=C1
InChIInChI=1S/C7H10N2/c8-5-4-7-3-1-2-6-9-7/h1,3,5,8H,2,4,6H2/b8-5+
InChIKeyVEGIVRREVASCSM-VMPITWQZSA-N
XLogP1.43
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Bis(imino)pyridine
CID 21972427
6-Ethyl-2,3-dihydropyridine
CID 58693567
2-Ethynyl-3-iminopyridine
CID 129798620
3-Iminopyridine
CID 21332821
4-Methanimidoylcyclohexa-2,4-dien-1-imine
CID 22338342
Pent-2-ene-1,5-diimine
CID 53718158
2,6-Dihydroazepin-3-imine
CID 57316147
(Z)-pent-2-ene-1,4-diimine
CID 59089718
2-N-methylcyclohexa-3,5-diene-1,2-diimine
CID 59789006
2,3-Dihydropyridin-6-ylmethanamine
CID 70426662
N-methyl-2H-pyridin-3-imine
CID 70547200
2-Methylidenepyridin-3-imine
CID 85854288

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydropyridin-6-yl)ethanimine?
The IUPAC name of 2-(2,3-dihydropyridin-6-yl)ethanimine (CID 90964112) is 2-(2,3-dihydropyridin-6-yl)ethanimine.
What is the SMILES notation for 2-(2,3-dihydropyridin-6-yl)ethanimine?
The canonical SMILES for 2-(2,3-dihydropyridin-6-yl)ethanimine is [H]/N=C/CC1=NCCC=C1.
What is the InChIKey of 2-(2,3-dihydropyridin-6-yl)ethanimine?
The InChIKey is VEGIVRREVASCSM-VMPITWQZSA-N. The full InChI is InChI=1S/C7H10N2/c8-5-4-7-3-1-2-6-9-7/h1,3,5,8H,2,4,6H2/b8-5+.
What are the key properties of 2-(2,3-dihydropyridin-6-yl)ethanimine?
2-(2,3-dihydropyridin-6-yl)ethanimine has a molecular weight of 122.17 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydropyridin-6-yl)ethanimine is sourced from PubChem (CID 90964112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).