N-(2,3-dimethylidene-4-pyridinyl)ethanimine

C9H10N2 — CID 123410529

IUPACN-(2,3-dimethylidene-4-pyridinyl)ethanimine
SMILESC=c1nccc(/N=C/C)c1=C
InChIInChI=1S/C9H10N2/c1-4-10-9-5-6-11-8(3)7(9)2/h4-6H,2-3H2,1H3/b10-4+
InChIKeyXHLQXJAEOLGKJZ-ONNFQVAWSA-N
MW146.19 g/mol
LogP0.62
Rot. Bonds1

About N-(2,3-dimethylidene-4-pyridinyl)ethanimine

N-(2,3-dimethylidene-4-pyridinyl)ethanimine (PubChem CID 123410529) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is N-(2,3-dimethylidene-4-pyridinyl)ethanimine.

Molecular Properties

Compound NameN-(2,3-dimethylidene-4-pyridinyl)ethanimine
PubChem CID123410529
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC NameN-(2,3-dimethylidene-4-pyridinyl)ethanimine
SMILESC=c1nccc(/N=C/C)c1=C
InChIInChI=1S/C9H10N2/c1-4-10-9-5-6-11-8(3)7(9)2/h4-6H,2-3H2,1H3/b10-4+
InChIKeyXHLQXJAEOLGKJZ-ONNFQVAWSA-N
XLogP0.62
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2E,3E)-2-ethylidene-3-(1-fluoropropylidene)pyridine
CID 90447928
3-(1-Fluoroethylidene)-2-propylidenepyridine
CID 123855748
(2E)-2-[(E)-3-fluorobut-2-enylidene]-4-methyl-3-methylidenepyridine
CID 135128526
4H-Pyrrolo[3,2-C]pyridine
CID 56972344
6-(3,4-Dihydropyridin-6-yl)-5-methyl-3,4-dihydropyridine
CID 57159616
5-methyl-6H-cyclopenta[b]pyrazine
CID 59467405
5-methyl-6H-cyclopenta[b]pyridine
CID 59944708
(2E)-3-methylidene-2-prop-2-enylidenepyridine
CID 60116677
(3Z)-3-(methyliminomethyl)hexa-1,3-dien-2-amine
CID 60123978
N-(6-methylcyclohexa-1,5-dien-1-yl)ethanimine
CID 68266833
N-[6-(methylideneamino)cyclohexa-1,5-dien-1-yl]ethanimine
CID 68360465
3-Methylidene-2-prop-2-enylidenepyridine
CID 72652539

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylidene-4-pyridinyl)ethanimine?
The IUPAC name of N-(2,3-dimethylidene-4-pyridinyl)ethanimine (CID 123410529) is N-(2,3-dimethylidene-4-pyridinyl)ethanimine.
What is the SMILES notation for N-(2,3-dimethylidene-4-pyridinyl)ethanimine?
The canonical SMILES for N-(2,3-dimethylidene-4-pyridinyl)ethanimine is C=c1nccc(/N=C/C)c1=C.
What is the InChIKey of N-(2,3-dimethylidene-4-pyridinyl)ethanimine?
The InChIKey is XHLQXJAEOLGKJZ-ONNFQVAWSA-N. The full InChI is InChI=1S/C9H10N2/c1-4-10-9-5-6-11-8(3)7(9)2/h4-6H,2-3H2,1H3/b10-4+.
What are the key properties of N-(2,3-dimethylidene-4-pyridinyl)ethanimine?
N-(2,3-dimethylidene-4-pyridinyl)ethanimine has a molecular weight of 146.19 g/mol, XLogP of 0.62, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylidene-4-pyridinyl)ethanimine is sourced from PubChem (CID 123410529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).