N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine

C34H26N4 — CID 23135801

IUPACN,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine
SMILESc1ccc(N(c2cccc(-c3cccc(N(c4ccccc4)c4ccccc4)n3)c2)c2ccccn2)cc1
InChIInChI=1S/C34H26N4/c1-4-15-28(16-5-1)37(29-17-6-2-7-18-29)34-24-13-22-32(36-34)27-14-12-21-31(26-27)38(30-19-8-3-9-20-30)33-23-10-11-25-35-33/h1-26H
InChIKeyHYFQSQWNSYDXAW-UHFFFAOYSA-N
MW490.61 g/mol
LogP9.08
Rot. Bonds7

About N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine

N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine (PubChem CID 23135801) has the molecular formula C34H26N4 and a molecular weight of 490.61 g/mol. Its IUPAC name is N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine.

Molecular Properties

Compound NameN,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine
PubChem CID23135801
Molecular FormulaC34H26N4
Molecular Weight490.61 g/mol
Exact Mass490.22
IUPAC NameN,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine
SMILESc1ccc(N(c2cccc(-c3cccc(N(c4ccccc4)c4ccccc4)n3)c2)c2ccccn2)cc1
InChIInChI=1S/C34H26N4/c1-4-15-28(16-5-1)37(29-17-6-2-7-18-29)34-24-13-22-32(36-34)27-14-12-21-31(26-27)38(30-19-8-3-9-20-30)33-23-10-11-25-35-33/h1-26H
InChIKeyHYFQSQWNSYDXAW-UHFFFAOYSA-N
XLogP9.08
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms38
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500490.61
LogP ≤ 59.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine?
The IUPAC name of N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine (CID 23135801) is N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine.
What is the SMILES notation for N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine?
The canonical SMILES for N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine is c1ccc(N(c2cccc(-c3cccc(N(c4ccccc4)c4ccccc4)n3)c2)c2ccccn2)cc1.
What is the InChIKey of N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine?
The InChIKey is HYFQSQWNSYDXAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26N4/c1-4-15-28(16-5-1)37(29-17-6-2-7-18-29)34-24-13-22-32(36-34)27-14-12-21-31(26-27)38(30-19-8-3-9-20-30)33-23-10-11-25-35-33/h1-26H.
What are the key properties of N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine?
N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine has a molecular weight of 490.61 g/mol, XLogP of 9.08, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine is sourced from PubChem (CID 23135801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).