(1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine

C14H14N4 — CID 145275038

IUPAC(1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine
SMILESN/C(=C\C=C(/N)c1ccccn1)c1ccccn1
InChIInChI=1S/C14H14N4/c15-11(13-5-1-3-9-17-13)7-8-12(16)14-6-2-4-10-18-14/h1-10H,15-16H2/b11-7-,12-8-
InChIKeyAGAOSORHDJHRNH-OXAWKVHCSA-N
MW238.29 g/mol
LogP1.78
Rot. Bonds3

About (1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine

(1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine (PubChem CID 145275038) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is (1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine.

Molecular Properties

Compound Name(1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine
PubChem CID145275038
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name(1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine
SMILESN/C(=C\C=C(/N)c1ccccn1)c1ccccn1
InChIInChI=1S/C14H14N4/c15-11(13-5-1-3-9-17-13)7-8-12(16)14-6-2-4-10-18-14/h1-10H,15-16H2/b11-7-,12-8-
InChIKeyAGAOSORHDJHRNH-OXAWKVHCSA-N
XLogP1.78
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(E)-1-pyridin-2-ylprop-1-en-1-amine
CID 55290780
(Z,1R)-1,3-diamino-3-pyridin-2-ylprop-2-en-1-ol
CID 124638933
(E)-1-amino-4,4-dimethyl-1-pyridin-2-ylpent-1-en-3-one
CID 818325
(Z)-2-[amino(ethyl)amino]-1-pyridin-2-ylethenamine
CID 171522165
N'-aminopyridine-2-carboximidamide
CID 5464234
pyridine-2-carbothioamide;hydrochloride
CID 57440257
(E)-2-pyridin-2-ylprop-1-en-1-amine
CID 22861961
ethane;N'-methylpyridine-2-carboximidamide
CID 143309787
(Z)-1-pyridin-2-yl-3-[[(2S)-pyrrolidin-2-yl]methylimino]prop-1-en-1-amine
CID 170977537
ethane;molecular hydrogen;pyridine-2-carboxamide
CID 145071770
2-[(E)-1,2-dichloroethenyl]pyridine
CID 146396959
(Z)-4,4,5,5,5-pentafluoro-3-imino-1-pyridin-2-ylpent-1-en-1-amine
CID 163705086

Frequently Asked Questions

What is the IUPAC name of (1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine?
The IUPAC name of (1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine (CID 145275038) is (1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine.
What is the SMILES notation for (1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine?
The canonical SMILES for (1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine is N/C(=C\C=C(/N)c1ccccn1)c1ccccn1.
What is the InChIKey of (1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine?
The InChIKey is AGAOSORHDJHRNH-OXAWKVHCSA-N. The full InChI is InChI=1S/C14H14N4/c15-11(13-5-1-3-9-17-13)7-8-12(16)14-6-2-4-10-18-14/h1-10H,15-16H2/b11-7-,12-8-.
What are the key properties of (1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine?
(1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine has a molecular weight of 238.29 g/mol, XLogP of 1.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z)-1,4-dipyridin-2-ylbuta-1,3-diene-1,4-diamine is sourced from PubChem (CID 145275038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).