N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine

C36H25N — CID 164774057

IUPACN-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine
SMILESc1ccc(N(c2ccc3ccccc3c2-c2ccc3ccccc3c2)c2cccc3ccccc23)cc1
InChIInChI=1S/C36H25N/c1-2-16-31(17-3-1)37(34-20-10-15-27-12-6-8-18-32(27)34)35-24-23-28-13-7-9-19-33(28)36(35)30-22-21-26-11-4-5-14-29(26)25-30/h1-25H
InChIKeyVUOORDAEVBDKSP-UHFFFAOYSA-N
MW471.60 g/mol
LogP10.28
Rot. Bonds4

About N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine

N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine (PubChem CID 164774057) has the molecular formula C36H25N and a molecular weight of 471.60 g/mol. Its IUPAC name is N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine.

Molecular Properties

Compound NameN-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine
PubChem CID164774057
Molecular FormulaC36H25N
Molecular Weight471.60 g/mol
Exact Mass471.20
IUPAC NameN-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine
SMILESc1ccc(N(c2ccc3ccccc3c2-c2ccc3ccccc3c2)c2cccc3ccccc23)cc1
InChIInChI=1S/C36H25N/c1-2-16-31(17-3-1)37(34-20-10-15-27-12-6-8-18-32(27)34)35-24-23-28-13-7-9-19-33(28)36(35)30-22-21-26-11-4-5-14-29(26)25-30/h1-25H
InChIKeyVUOORDAEVBDKSP-UHFFFAOYSA-N
XLogP10.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms37
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.60
LogP ≤ 510.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine?
The IUPAC name of N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine (CID 164774057) is N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine.
What is the SMILES notation for N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine?
The canonical SMILES for N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine is c1ccc(N(c2ccc3ccccc3c2-c2ccc3ccccc3c2)c2cccc3ccccc23)cc1.
What is the InChIKey of N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine?
The InChIKey is VUOORDAEVBDKSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H25N/c1-2-16-31(17-3-1)37(34-20-10-15-27-12-6-8-18-32(27)34)35-24-23-28-13-7-9-19-33(28)36(35)30-22-21-26-11-4-5-14-29(26)25-30/h1-25H.
What are the key properties of N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine?
N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine has a molecular weight of 471.60 g/mol, XLogP of 10.28, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-1-naphthalen-2-yl-N-phenylnaphthalen-2-amine is sourced from PubChem (CID 164774057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).