N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine

C26H19N3 — CID 71606172

IUPACN-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine
SMILESC(=N/N(c1ccc2ccccc2c1)c1ccc2ccccc2c1)\c1ccccn1
InChIInChI=1S/C26H19N3/c1-3-9-22-17-25(14-12-20(22)7-1)29(28-19-24-11-5-6-16-27-24)26-15-13-21-8-2-4-10-23(21)18-26/h1-19H/b28-19+
InChIKeyKJGQSNLNABCIEC-TURZUDJPSA-N
MW373.46 g/mol
LogP6.56
Rot. Bonds4

About N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine

N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine (PubChem CID 71606172) has the molecular formula C26H19N3 and a molecular weight of 373.46 g/mol. Its IUPAC name is N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine.

Molecular Properties

Compound NameN-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine
PubChem CID71606172
Molecular FormulaC26H19N3
Molecular Weight373.46 g/mol
Exact Mass373.16
IUPAC NameN-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine
SMILESC(=N/N(c1ccc2ccccc2c1)c1ccc2ccccc2c1)\c1ccccn1
InChIInChI=1S/C26H19N3/c1-3-9-22-17-25(14-12-20(22)7-1)29(28-19-24-11-5-6-16-27-24)26-15-13-21-8-2-4-10-23(21)18-26/h1-19H/b28-19+
InChIKeyKJGQSNLNABCIEC-TURZUDJPSA-N
XLogP6.56
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.46
LogP ≤ 56.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine?
The IUPAC name of N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine (CID 71606172) is N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine.
What is the SMILES notation for N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine?
The canonical SMILES for N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine is C(=N/N(c1ccc2ccccc2c1)c1ccc2ccccc2c1)\c1ccccn1.
What is the InChIKey of N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine?
The InChIKey is KJGQSNLNABCIEC-TURZUDJPSA-N. The full InChI is InChI=1S/C26H19N3/c1-3-9-22-17-25(14-12-20(22)7-1)29(28-19-24-11-5-6-16-27-24)26-15-13-21-8-2-4-10-23(21)18-26/h1-19H/b28-19+.
What are the key properties of N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine?
N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine has a molecular weight of 373.46 g/mol, XLogP of 6.56, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine is sourced from PubChem (CID 71606172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).