N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine

C32H23N3 — CID 90070849

IUPACN-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine
SMILESc1ccc(-c2cc(Nc3cccc(-c4cccc5ccccc45)n3)nc(-c3ccccc3)c2)cc1
InChIInChI=1S/C32H23N3/c1-3-11-23(12-4-1)26-21-30(25-14-5-2-6-15-25)34-32(22-26)35-31-20-10-19-29(33-31)28-18-9-16-24-13-7-8-17-27(24)28/h1-22H,(H,33,34,35)
InChIKeyOUGOORAQRVIANA-UHFFFAOYSA-N
MW449.56 g/mol
LogP8.37
Rot. Bonds5

About N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine

N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine (PubChem CID 90070849) has the molecular formula C32H23N3 and a molecular weight of 449.56 g/mol. Its IUPAC name is N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine.

Molecular Properties

Compound NameN-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine
PubChem CID90070849
Molecular FormulaC32H23N3
Molecular Weight449.56 g/mol
Exact Mass449.19
IUPAC NameN-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine
SMILESc1ccc(-c2cc(Nc3cccc(-c4cccc5ccccc45)n3)nc(-c3ccccc3)c2)cc1
InChIInChI=1S/C32H23N3/c1-3-11-23(12-4-1)26-21-30(25-14-5-2-6-15-25)34-32(22-26)35-31-20-10-19-29(33-31)28-18-9-16-24-13-7-8-17-27(24)28/h1-22H,(H,33,34,35)
InChIKeyOUGOORAQRVIANA-UHFFFAOYSA-N
XLogP8.37
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms35
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500449.56
LogP ≤ 58.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine?
The IUPAC name of N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine (CID 90070849) is N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine.
What is the SMILES notation for N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine?
The canonical SMILES for N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine is c1ccc(-c2cc(Nc3cccc(-c4cccc5ccccc45)n3)nc(-c3ccccc3)c2)cc1.
What is the InChIKey of N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine?
The InChIKey is OUGOORAQRVIANA-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H23N3/c1-3-11-23(12-4-1)26-21-30(25-14-5-2-6-15-25)34-32(22-26)35-31-20-10-19-29(33-31)28-18-9-16-24-13-7-8-17-27(24)28/h1-22H,(H,33,34,35).
What are the key properties of N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine?
N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine has a molecular weight of 449.56 g/mol, XLogP of 8.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-naphthalen-1-yl-2-pyridinyl)-4,6-diphenylpyridin-2-amine is sourced from PubChem (CID 90070849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).