(2-azaniumyl-1,2-diphenylethenyl)azanium

C14H16N2+2 — CID 5108599

IUPAC(2-azaniumyl-1,2-diphenylethenyl)azanium
SMILES[NH3+]C(=C([NH3+])c1ccccc1)c1ccccc1
InChIInChI=1S/C14H14N2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10H,15-16H2/p+2
InChIKeyTXVWTOBHDDIASC-UHFFFAOYSA-P
MW212.30 g/mol
LogP1.00
Rot. Bonds2

About (2-azaniumyl-1,2-diphenylethenyl)azanium

(2-azaniumyl-1,2-diphenylethenyl)azanium (PubChem CID 5108599) has the molecular formula C14H16N2+2 and a molecular weight of 212.30 g/mol. Its IUPAC name is (2-azaniumyl-1,2-diphenylethenyl)azanium.

Molecular Properties

Compound Name(2-azaniumyl-1,2-diphenylethenyl)azanium
PubChem CID5108599
Molecular FormulaC14H16N2+2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name(2-azaniumyl-1,2-diphenylethenyl)azanium
SMILES[NH3+]C(=C([NH3+])c1ccccc1)c1ccccc1
InChIInChI=1S/C14H14N2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10H,15-16H2/p+2
InChIKeyTXVWTOBHDDIASC-UHFFFAOYSA-P
XLogP1.00
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

CID 12505640
CID 12505640
(Z)-1,2-diphenylethene-1,2-diol
CID 11012436
ethane;1-phenylethanone;propan-2-one
CID 91456675
1-(cyclotetradecaheptaenyl)ethanone
CID 90871438
CID 67882804
CID 67882804
phosphane;1,2,2-triphenylethenylbenzene
CID 157288563
bis(1,2-diphenylethane-1,2-dione);hydrogen peroxide
CID 18415505
lithium 1-phenylethanone
CID 22269591
iron;1-phenylethanone
CID 70488357
potassium 1-phenylethanone
CID 19980201
acetic acid;1-phenylethanone
CID 159392478
1,2-diphenylethane-1,2-di(18O2)one
CID 101209635

Frequently Asked Questions

What is the IUPAC name of (2-azaniumyl-1,2-diphenylethenyl)azanium?
The IUPAC name of (2-azaniumyl-1,2-diphenylethenyl)azanium (CID 5108599) is (2-azaniumyl-1,2-diphenylethenyl)azanium.
What is the SMILES notation for (2-azaniumyl-1,2-diphenylethenyl)azanium?
The canonical SMILES for (2-azaniumyl-1,2-diphenylethenyl)azanium is [NH3+]C(=C([NH3+])c1ccccc1)c1ccccc1.
What is the InChIKey of (2-azaniumyl-1,2-diphenylethenyl)azanium?
The InChIKey is TXVWTOBHDDIASC-UHFFFAOYSA-P. The full InChI is InChI=1S/C14H14N2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10H,15-16H2/p+2.
What are the key properties of (2-azaniumyl-1,2-diphenylethenyl)azanium?
(2-azaniumyl-1,2-diphenylethenyl)azanium has a molecular weight of 212.30 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-azaniumyl-1,2-diphenylethenyl)azanium is sourced from PubChem (CID 5108599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).