(E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine

C12H12N4 — CID 43835872

IUPAC(E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine
SMILESC/C=N/N=C(\C)c1cnc2ccccc2n1
InChIInChI=1S/C12H12N4/c1-3-14-16-9(2)12-8-13-10-6-4-5-7-11(10)15-12/h3-8H,1-2H3/b14-3+,16-9+
InChIKeyASNARPVLXYCKGO-ZFDMWBGCSA-N
MW212.26 g/mol
LogP2.44
Rot. Bonds2

About (E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine

(E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine (PubChem CID 43835872) has the molecular formula C12H12N4 and a molecular weight of 212.26 g/mol. Its IUPAC name is (E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine.

Molecular Properties

Compound Name(E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine
PubChem CID43835872
Molecular FormulaC12H12N4
Molecular Weight212.26 g/mol
Exact Mass212.11
IUPAC Name(E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine
SMILESC/C=N/N=C(\C)c1cnc2ccccc2n1
InChIInChI=1S/C12H12N4/c1-3-14-16-9(2)12-8-13-10-6-4-5-7-11(10)15-12/h3-8H,1-2H3/b14-3+,16-9+
InChIKeyASNARPVLXYCKGO-ZFDMWBGCSA-N
XLogP2.44
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.26
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethyl-N'-(1-quinoxalin-2-ylethylideneamino)methanimidamide
CID 74516256
2-[(Z)-1-quinoxalin-2-ylethylideneamino]guanidine
CID 26974287
2-[(E)-1-fluoroprop-1-enyl]quinoxaline
CID 173227234
N-(1-quinoxalin-2-ylethylideneamino)acetamide
CID 74516260
N-[(Z)-1-quinoxalin-2-ylethylideneamino]pyridine-4-carboxamide
CID 26974464
(2Z)-2-hydroxyimino-1-quinoxalin-2-ylethanone
CID 27191067
3-chloro-N-[(E)-1-quinoxalin-2-ylethylideneamino]aniline
CID 43835805
4-phenyl-N-[(E)-1-quinoxalin-2-ylethylideneamino]-1,3-thiazol-2-amine
CID 43835823
1-quinoxalin-2-ylhexan-1-one
CID 102319889
(2-oxo-2-quinoxalin-2-ylethyl) acetate
CID 119091259
2-amino-1-quinoxalin-2-ylpropan-1-one
CID 84670100
2-[(E)-1,2-dibromo-3,3-dimethylbut-1-enyl]quinoxaline
CID 10785364

Frequently Asked Questions

What is the IUPAC name of (E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine?
The IUPAC name of (E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine (CID 43835872) is (E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine.
What is the SMILES notation for (E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine?
The canonical SMILES for (E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine is C/C=N/N=C(\C)c1cnc2ccccc2n1.
What is the InChIKey of (E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine?
The InChIKey is ASNARPVLXYCKGO-ZFDMWBGCSA-N. The full InChI is InChI=1S/C12H12N4/c1-3-14-16-9(2)12-8-13-10-6-4-5-7-11(10)15-12/h3-8H,1-2H3/b14-3+,16-9+.
What are the key properties of (E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine?
(E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine has a molecular weight of 212.26 g/mol, XLogP of 2.44, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[(E)-ethylideneamino]-1-quinoxalin-2-ylethanimine is sourced from PubChem (CID 43835872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).