4-(3-aminoprop-2-enyl)-N-phenylaniline

C15H16N2 — CID 150288226

IUPAC4-(3-aminoprop-2-enyl)-N-phenylaniline
SMILESNC=CCc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C15H16N2/c16-12-4-5-13-8-10-15(11-9-13)17-14-6-2-1-3-7-14/h1-4,6-12,17H,5,16H2
InChIKeyGHAKCWRZJYHHRE-UHFFFAOYSA-N
MW224.31 g/mol
LogP3.45
Rot. Bonds4

About 4-(3-aminoprop-2-enyl)-N-phenylaniline

4-(3-aminoprop-2-enyl)-N-phenylaniline (PubChem CID 150288226) has the molecular formula C15H16N2 and a molecular weight of 224.31 g/mol. Its IUPAC name is 4-(3-aminoprop-2-enyl)-N-phenylaniline.

Molecular Properties

Compound Name4-(3-aminoprop-2-enyl)-N-phenylaniline
PubChem CID150288226
Molecular FormulaC15H16N2
Molecular Weight224.31 g/mol
Exact Mass224.13
IUPAC Name4-(3-aminoprop-2-enyl)-N-phenylaniline
SMILESNC=CCc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C15H16N2/c16-12-4-5-13-8-10-15(11-9-13)17-14-6-2-1-3-7-14/h1-4,6-12,17H,5,16H2
InChIKeyGHAKCWRZJYHHRE-UHFFFAOYSA-N
XLogP3.45
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-aminoprop-2-enyl)-N-phenylaniline?
The IUPAC name of 4-(3-aminoprop-2-enyl)-N-phenylaniline (CID 150288226) is 4-(3-aminoprop-2-enyl)-N-phenylaniline.
What is the SMILES notation for 4-(3-aminoprop-2-enyl)-N-phenylaniline?
The canonical SMILES for 4-(3-aminoprop-2-enyl)-N-phenylaniline is NC=CCc1ccc(Nc2ccccc2)cc1.
What is the InChIKey of 4-(3-aminoprop-2-enyl)-N-phenylaniline?
The InChIKey is GHAKCWRZJYHHRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2/c16-12-4-5-13-8-10-15(11-9-13)17-14-6-2-1-3-7-14/h1-4,6-12,17H,5,16H2.
What are the key properties of 4-(3-aminoprop-2-enyl)-N-phenylaniline?
4-(3-aminoprop-2-enyl)-N-phenylaniline has a molecular weight of 224.31 g/mol, XLogP of 3.45, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-aminoprop-2-enyl)-N-phenylaniline is sourced from PubChem (CID 150288226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).