N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine

C36H25NO — CID 170400225

IUPACN-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine
SMILESc1ccc(-c2c(-c3cccc(N(c4ccccc4)c4cccc5ccccc45)c3)oc3ccccc23)cc1
InChIInChI=1S/C36H25NO/c1-3-14-27(15-4-1)35-32-22-9-10-24-34(32)38-36(35)28-17-11-20-30(25-28)37(29-18-5-2-6-19-29)33-23-12-16-26-13-7-8-21-31(26)33/h1-25H
InChIKeyUDZQEPYLRYAVRM-UHFFFAOYSA-N
MW487.60 g/mol
LogP10.39
Rot. Bonds5

About N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine

N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine (PubChem CID 170400225) has the molecular formula C36H25NO and a molecular weight of 487.60 g/mol. Its IUPAC name is N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine.

Molecular Properties

Compound NameN-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine
PubChem CID170400225
Molecular FormulaC36H25NO
Molecular Weight487.60 g/mol
Exact Mass487.19
IUPAC NameN-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine
SMILESc1ccc(-c2c(-c3cccc(N(c4ccccc4)c4cccc5ccccc45)c3)oc3ccccc23)cc1
InChIInChI=1S/C36H25NO/c1-3-14-27(15-4-1)35-32-22-9-10-24-34(32)38-36(35)28-17-11-20-30(25-28)37(29-18-5-2-6-19-29)33-23-12-16-26-13-7-8-21-31(26)33/h1-25H
InChIKeyUDZQEPYLRYAVRM-UHFFFAOYSA-N
XLogP10.39
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.60
LogP ≤ 510.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine
CID 170526453
N,2-diphenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]aniline
CID 170400224
N-naphthalen-1-yl-N-[4-[4-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]phenyl]phenyl]phenanthren-2-amine
CID 170401768
N-[4-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]phenyl]-N-[4-(2-phenylphenyl)phenyl]naphthalen-1-amine
CID 170399193
N-[4-(3-naphthalen-1-ylphenyl)phenyl]-N-[4-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]phenyl]naphthalen-1-amine
CID 170402291
N-phenyl-N-[2-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine
CID 170526305
3-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 170400196
N-(4-phenanthren-2-ylphenyl)-3-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]aniline
CID 170526121
N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]-N-(3-phenylphenyl)phenanthren-2-amine
CID 170400243
N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]phenanthren-9-amine
CID 170526212
3-naphthalen-2-yl-N-phenyl-N-[4-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]phenyl]aniline
CID 170402234
N-(4-naphthalen-1-ylphenyl)-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-2-amine
CID 170400161

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine?
The IUPAC name of N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine (CID 170400225) is N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine.
What is the SMILES notation for N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine?
The canonical SMILES for N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine is c1ccc(-c2c(-c3cccc(N(c4ccccc4)c4cccc5ccccc45)c3)oc3ccccc23)cc1.
What is the InChIKey of N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine?
The InChIKey is UDZQEPYLRYAVRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H25NO/c1-3-14-27(15-4-1)35-32-22-9-10-24-34(32)38-36(35)28-17-11-20-30(25-28)37(29-18-5-2-6-19-29)33-23-12-16-26-13-7-8-21-31(26)33/h1-25H.
What are the key properties of N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine?
N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine has a molecular weight of 487.60 g/mol, XLogP of 10.39, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine is sourced from PubChem (CID 170400225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).