N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine

C24H19N — CID 5387657

IUPACN-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine
SMILESC(=C/c1ccc2ccccc2c1Nc1ccccc1)\c1ccccc1
InChIInChI=1S/C24H19N/c1-3-9-19(10-4-1)15-16-21-18-17-20-11-7-8-14-23(20)24(21)25-22-12-5-2-6-13-22/h1-18,25H/b16-15+
InChIKeyIFRHMPNZNUXBHQ-FOCLMDBBSA-N
MW321.42 g/mol
LogP6.75
Rot. Bonds4

About N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine

N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine (PubChem CID 5387657) has the molecular formula C24H19N and a molecular weight of 321.42 g/mol. Its IUPAC name is N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine.

Molecular Properties

Compound NameN-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine
PubChem CID5387657
Molecular FormulaC24H19N
Molecular Weight321.42 g/mol
Exact Mass321.15
IUPAC NameN-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine
SMILESC(=C/c1ccc2ccccc2c1Nc1ccccc1)\c1ccccc1
InChIInChI=1S/C24H19N/c1-3-9-19(10-4-1)15-16-21-18-17-20-11-7-8-14-23(20)24(21)25-22-12-5-2-6-13-22/h1-18,25H/b16-15+
InChIKeyIFRHMPNZNUXBHQ-FOCLMDBBSA-N
XLogP6.75
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.42
LogP ≤ 56.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine?
The IUPAC name of N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine (CID 5387657) is N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine.
What is the SMILES notation for N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine?
The canonical SMILES for N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine is C(=C/c1ccc2ccccc2c1Nc1ccccc1)\c1ccccc1.
What is the InChIKey of N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine?
The InChIKey is IFRHMPNZNUXBHQ-FOCLMDBBSA-N. The full InChI is InChI=1S/C24H19N/c1-3-9-19(10-4-1)15-16-21-18-17-20-11-7-8-14-23(20)24(21)25-22-12-5-2-6-13-22/h1-18,25H/b16-15+.
What are the key properties of N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine?
N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine has a molecular weight of 321.42 g/mol, XLogP of 6.75, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-[(E)-2-phenylethenyl]naphthalen-1-amine is sourced from PubChem (CID 5387657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).