4-ethenyl-N-phenylaniline

C14H13N — CID 21478062

IUPAC4-ethenyl-N-phenylaniline
SMILESC=Cc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C14H13N/c1-2-12-8-10-14(11-9-12)15-13-6-4-3-5-7-13/h2-11,15H,1H2
InChIKeyLACXPJFSAYBBOA-UHFFFAOYSA-N
MW195.26 g/mol
LogP4.07
Rot. Bonds3

About 4-ethenyl-N-phenylaniline

4-ethenyl-N-phenylaniline (PubChem CID 21478062) has the molecular formula C14H13N and a molecular weight of 195.26 g/mol. Its IUPAC name is 4-ethenyl-N-phenylaniline.

Molecular Properties

Compound Name4-ethenyl-N-phenylaniline
PubChem CID21478062
Molecular FormulaC14H13N
Molecular Weight195.26 g/mol
Exact Mass195.10
IUPAC Name4-ethenyl-N-phenylaniline
SMILESC=Cc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C14H13N/c1-2-12-8-10-14(11-9-12)15-13-6-4-3-5-7-13/h2-11,15H,1H2
InChIKeyLACXPJFSAYBBOA-UHFFFAOYSA-N
XLogP4.07
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-N-phenylaniline?
The IUPAC name of 4-ethenyl-N-phenylaniline (CID 21478062) is 4-ethenyl-N-phenylaniline.
What is the SMILES notation for 4-ethenyl-N-phenylaniline?
The canonical SMILES for 4-ethenyl-N-phenylaniline is C=Cc1ccc(Nc2ccccc2)cc1.
What is the InChIKey of 4-ethenyl-N-phenylaniline?
The InChIKey is LACXPJFSAYBBOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N/c1-2-12-8-10-14(11-9-12)15-13-6-4-3-5-7-13/h2-11,15H,1H2.
What are the key properties of 4-ethenyl-N-phenylaniline?
4-ethenyl-N-phenylaniline has a molecular weight of 195.26 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-N-phenylaniline is sourced from PubChem (CID 21478062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).