(Z)-N'-propylideneprop-2-ene-1,3-diimine

C6H10N2 — CID 123520631

IUPAC(Z)-N'-propylideneprop-2-ene-1,3-diimine
SMILES[H]/N=C/C=C\N=C\CC
InChIInChI=1S/C6H10N2/c1-2-5-8-6-3-4-7/h3-7H,2H2,1H3/b6-3-,7-4+,8-5+
InChIKeyZQXKPHVTSRWBSX-INZYDDJUSA-N
MW110.16 g/mol
LogP1.63
Rot. Bonds3

About (Z)-N'-propylideneprop-2-ene-1,3-diimine

(Z)-N'-propylideneprop-2-ene-1,3-diimine (PubChem CID 123520631) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is (Z)-N'-propylideneprop-2-ene-1,3-diimine.

Molecular Properties

Compound Name(Z)-N'-propylideneprop-2-ene-1,3-diimine
PubChem CID123520631
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name(Z)-N'-propylideneprop-2-ene-1,3-diimine
SMILES[H]/N=C/C=C\N=C\CC
InChIInChI=1S/C6H10N2/c1-2-5-8-6-3-4-7/h3-7H,2H2,1H3/b6-3-,7-4+,8-5+
InChIKeyZQXKPHVTSRWBSX-INZYDDJUSA-N
XLogP1.63
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.63
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

methanaminium, N-[(2E)-3-(dimethylamino)-2-propenylidene]-N-methyl-
CID 638326
Methanaminium, N-[3-(dimethylamino)-2-propenylidene]-N-methyl-
CID 3994380
(1E)-N-(Prop-1-en-1-yl)propan-1-imine
CID 54113889
N-methyl-N'-methylideneprop-2-ene-1,3-diimine
CID 91606293
2-fluoro-N'-propylideneprop-2-ene-1,3-diimine
CID 123333938
N-[(Z)-3-iminoprop-1-enyl]methanimidoyl fluoride
CID 169963153
(Z)-N-methyl-3-methyliminoprop-1-en-1-amine
CID 10606703
N-(3-methylamino-2-propenylidene)methylamine
CID 85203886
2,5-Diaza-octatetraene
CID 129694245
[(Z)-3-(dimethylamino)prop-2-enylidene]-dimethylazanium
CID 96570747
(E)-N-methyl-3-methyliminoprop-1-en-1-amine
CID 12425496
N-[(E)-prop-1-enyl]propan-1-imine
CID 12603153

Frequently Asked Questions

What is the IUPAC name of (Z)-N'-propylideneprop-2-ene-1,3-diimine?
The IUPAC name of (Z)-N'-propylideneprop-2-ene-1,3-diimine (CID 123520631) is (Z)-N'-propylideneprop-2-ene-1,3-diimine.
What is the SMILES notation for (Z)-N'-propylideneprop-2-ene-1,3-diimine?
The canonical SMILES for (Z)-N'-propylideneprop-2-ene-1,3-diimine is [H]/N=C/C=C\N=C\CC.
What is the InChIKey of (Z)-N'-propylideneprop-2-ene-1,3-diimine?
The InChIKey is ZQXKPHVTSRWBSX-INZYDDJUSA-N. The full InChI is InChI=1S/C6H10N2/c1-2-5-8-6-3-4-7/h3-7H,2H2,1H3/b6-3-,7-4+,8-5+.
What are the key properties of (Z)-N'-propylideneprop-2-ene-1,3-diimine?
(Z)-N'-propylideneprop-2-ene-1,3-diimine has a molecular weight of 110.16 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-propylideneprop-2-ene-1,3-diimine is sourced from PubChem (CID 123520631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).