2-N,6-N-diphenylnaphthalene-2,6-diamine

C22H18N2 — CID 12541294

IUPAC2-N,6-N-diphenylnaphthalene-2,6-diamine
SMILESc1ccc(Nc2ccc3cc(Nc4ccccc4)ccc3c2)cc1
InChIInChI=1S/C22H18N2/c1-3-7-19(8-4-1)23-21-13-11-18-16-22(14-12-17(18)15-21)24-20-9-5-2-6-10-20/h1-16,23-24H
InChIKeyHYAJAQJRMHKRIZ-UHFFFAOYSA-N
MW310.40 g/mol
LogP6.33
Rot. Bonds4

About 2-N,6-N-diphenylnaphthalene-2,6-diamine

2-N,6-N-diphenylnaphthalene-2,6-diamine (PubChem CID 12541294) has the molecular formula C22H18N2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 2-N,6-N-diphenylnaphthalene-2,6-diamine.

Molecular Properties

Compound Name2-N,6-N-diphenylnaphthalene-2,6-diamine
PubChem CID12541294
Molecular FormulaC22H18N2
Molecular Weight310.40 g/mol
Exact Mass310.15
IUPAC Name2-N,6-N-diphenylnaphthalene-2,6-diamine
SMILESc1ccc(Nc2ccc3cc(Nc4ccccc4)ccc3c2)cc1
InChIInChI=1S/C22H18N2/c1-3-7-19(8-4-1)23-21-13-11-18-16-22(14-12-17(18)15-21)24-20-9-5-2-6-10-20/h1-16,23-24H
InChIKeyHYAJAQJRMHKRIZ-UHFFFAOYSA-N
XLogP6.33
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.40
LogP ≤ 56.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-diphenylnaphthalene-2,6-diamine?
The IUPAC name of 2-N,6-N-diphenylnaphthalene-2,6-diamine (CID 12541294) is 2-N,6-N-diphenylnaphthalene-2,6-diamine.
What is the SMILES notation for 2-N,6-N-diphenylnaphthalene-2,6-diamine?
The canonical SMILES for 2-N,6-N-diphenylnaphthalene-2,6-diamine is c1ccc(Nc2ccc3cc(Nc4ccccc4)ccc3c2)cc1.
What is the InChIKey of 2-N,6-N-diphenylnaphthalene-2,6-diamine?
The InChIKey is HYAJAQJRMHKRIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2/c1-3-7-19(8-4-1)23-21-13-11-18-16-22(14-12-17(18)15-21)24-20-9-5-2-6-10-20/h1-16,23-24H.
What are the key properties of 2-N,6-N-diphenylnaphthalene-2,6-diamine?
2-N,6-N-diphenylnaphthalene-2,6-diamine has a molecular weight of 310.40 g/mol, XLogP of 6.33, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-diphenylnaphthalene-2,6-diamine is sourced from PubChem (CID 12541294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).