(4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine

C15H19N3 — CID 142583605

IUPAC(4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine
SMILES[H]/N=C/C(=C\C)C(=C)/C=c1/cc(NC)nc/c1=C/C
InChIInChI=1S/C15H19N3/c1-5-12(9-16)11(3)7-14-8-15(17-4)18-10-13(14)6-2/h5-10,16-17H,3H2,1-2,4H3/b12-5+,13-6-,14-7-,16-9+
InChIKeyXTYVKYPVMPXXPB-UHOGCCFBSA-N
MW241.34 g/mol
LogP1.86
Rot. Bonds4

About (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine

(4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine (PubChem CID 142583605) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name(4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine
PubChem CID142583605
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name(4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine
SMILES[H]/N=C/C(=C\C)C(=C)/C=c1/cc(NC)nc/c1=C/C
InChIInChI=1S/C15H19N3/c1-5-12(9-16)11(3)7-14-8-15(17-4)18-10-13(14)6-2/h5-10,16-17H,3H2,1-2,4H3/b12-5+,13-6-,14-7-,16-9+
InChIKeyXTYVKYPVMPXXPB-UHOGCCFBSA-N
XLogP1.86
TPSA48.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Methyl-[2,5,8-trimethyl-9-(methylamino)nona-2,4,6,8-tetraenylidene]azanium
CID 59962921
(Z)-2-[[(2E)-2-ethenylpenta-2,4-dienylidene]amino]-1-N'-methylethene-1,1-diamine
CID 89153792
N,3-dimethyl-5-(5-methyloct-4-en-4-yl)-2,3-dihydropyridin-2-amine
CID 91464468
[4-(1-Aminoethenyliminomethyl)-3-methylpenta-2,4-dienylidene]-dimethylazanium
CID 123599154
(5E)-6-methylidene-5-[(Z)-3-methylpent-2-enylidene]-1,2-dihydropyrimidine
CID 126583286
(6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine
CID 130389549
8-methyl-2,7-dimethylidene-1H-1,3-diazonine
CID 132191314
Ethane;2-methyl-5-(2-methyl-1,2-dihydropyridin-5-yl)-1,2-dihydropyrimidine
CID 141810255
CID 141844044
CID 141844044
(2Z)-5-methyl-2-(4-methylcyclohepta-2,4,6-trien-1-ylidene)-1H-pyrimidine
CID 141985325
N,N'-dimethyl-N'-[1-[(Z)-[(E)-3-methyl-2-methylidenepent-3-enylidene]amino]ethenyl]ethane-1,2-diamine;ethane
CID 142170699
(4Z,5E)-4-(2-chloroprop-2-enylidene)-5-ethylidenepyridin-2-amine;ethane
CID 142583554

Frequently Asked Questions

What is the IUPAC name of (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine?
The IUPAC name of (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine (CID 142583605) is (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine.
What is the SMILES notation for (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine?
The canonical SMILES for (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine is [H]/N=C/C(=C\C)C(=C)/C=c1/cc(NC)nc/c1=C/C.
What is the InChIKey of (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine?
The InChIKey is XTYVKYPVMPXXPB-UHOGCCFBSA-N. The full InChI is InChI=1S/C15H19N3/c1-5-12(9-16)11(3)7-14-8-15(17-4)18-10-13(14)6-2/h5-10,16-17H,3H2,1-2,4H3/b12-5+,13-6-,14-7-,16-9+.
What are the key properties of (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine?
(4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine has a molecular weight of 241.34 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z,5E)-5-ethylidene-4-[(Z)-3-methanimidoyl-2-methylidenepent-3-enylidene]-N-methylpyridin-2-amine is sourced from PubChem (CID 142583605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).