(4-ethenylphenyl)methylazanium

C9H12N+ — CID 86307073

IUPAC(4-ethenylphenyl)methylazanium
SMILESC=Cc1ccc(C[NH3+])cc1
InChIInChI=1S/C9H11N/c1-2-8-3-5-9(7-10)6-4-8/h2-6H,1,7,10H2/p+1
InChIKeyWAVDSLLYAQBITE-UHFFFAOYSA-O
MW134.20 g/mol
LogP1.07
Rot. Bonds2

About (4-ethenylphenyl)methylazanium

(4-ethenylphenyl)methylazanium (PubChem CID 86307073) has the molecular formula C9H12N+ and a molecular weight of 134.20 g/mol. Its IUPAC name is (4-ethenylphenyl)methylazanium.

Molecular Properties

Compound Name(4-ethenylphenyl)methylazanium
PubChem CID86307073
Molecular FormulaC9H12N+
Molecular Weight134.20 g/mol
Exact Mass134.10
IUPAC Name(4-ethenylphenyl)methylazanium
SMILESC=Cc1ccc(C[NH3+])cc1
InChIInChI=1S/C9H11N/c1-2-8-3-5-9(7-10)6-4-8/h2-6H,1,7,10H2/p+1
InChIKeyWAVDSLLYAQBITE-UHFFFAOYSA-O
XLogP1.07
TPSA27.64 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.20
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Analyze (4-ethenylphenyl)methylazanium 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

1,4-bis[(4-ethenylphenyl)methyl]benzene
CID 20738932
1-ethenyl-4-[[4-[[4-[(4-ethenylphenyl)methyl]phenyl]methyl]phenyl]methyl]benzene
CID 163649628
2-(4-ethenylphenyl)ethane-1,1-diol
CID 166912920
1-(chloromethyl)-4-ethenylbenzene;phosphane
CID 87786462
(4-ethenylphenyl)methylphosphanium tetrafluoroborate
CID 174226333
1-ethenyl-4-(phosphorosomethyl)benzene
CID 175486425
tert-butyl(dimethyl)silane;(4-ethenylphenyl)methanol
CID 175113696
1,4-bis[(4-ethenylphenyl)methylsulfanyl]benzene
CID 14745002
1,3-bis[2-(4-ethenylphenyl)ethyl]benzene
CID 20738929
3-(4-ethenylphenyl)propane-1-thiol
CID 59552728
1-ethenyl-4-(2-methylbut-2-enyl)benzene
CID 139941573
(4-ethenylphenyl)methanesulfinate
CID 174404889

Frequently Asked Questions

What is the IUPAC name of (4-ethenylphenyl)methylazanium?
The IUPAC name of (4-ethenylphenyl)methylazanium (CID 86307073) is (4-ethenylphenyl)methylazanium.
What is the SMILES notation for (4-ethenylphenyl)methylazanium?
The canonical SMILES for (4-ethenylphenyl)methylazanium is C=Cc1ccc(C[NH3+])cc1.
What is the InChIKey of (4-ethenylphenyl)methylazanium?
The InChIKey is WAVDSLLYAQBITE-UHFFFAOYSA-O. The full InChI is InChI=1S/C9H11N/c1-2-8-3-5-9(7-10)6-4-8/h2-6H,1,7,10H2/p+1.
What are the key properties of (4-ethenylphenyl)methylazanium?
(4-ethenylphenyl)methylazanium has a molecular weight of 134.20 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethenylphenyl)methylazanium is sourced from PubChem (CID 86307073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).