6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine

C38H25NO — CID 169295404

IUPAC6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine
SMILESc1ccc(N(c2ccccc2)c2ccc3c(c2)oc2c(-c4ccc5ccccc5c4)c4ccccc4cc23)cc1
InChIInChI=1S/C38H25NO/c1-3-14-30(15-4-1)39(31-16-5-2-6-17-31)32-21-22-34-35-24-28-13-9-10-18-33(28)37(38(35)40-36(34)25-32)29-20-19-26-11-7-8-12-27(26)23-29/h1-25H
InChIKeyCPNCVTULUSEBOQ-UHFFFAOYSA-N
MW511.62 g/mol
LogP11.03
Rot. Bonds4

About 6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine

6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine (PubChem CID 169295404) has the molecular formula C38H25NO and a molecular weight of 511.62 g/mol. Its IUPAC name is 6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine.

Molecular Properties

Compound Name6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine
PubChem CID169295404
Molecular FormulaC38H25NO
Molecular Weight511.62 g/mol
Exact Mass511.19
IUPAC Name6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine
SMILESc1ccc(N(c2ccccc2)c2ccc3c(c2)oc2c(-c4ccc5ccccc5c4)c4ccccc4cc23)cc1
InChIInChI=1S/C38H25NO/c1-3-14-30(15-4-1)39(31-16-5-2-6-17-31)32-21-22-34-35-24-28-13-9-10-18-33(28)37(38(35)40-36(34)25-32)29-20-19-26-11-7-8-12-27(26)23-29/h1-25H
InChIKeyCPNCVTULUSEBOQ-UHFFFAOYSA-N
XLogP11.03
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500511.62
LogP ≤ 511.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[3-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[2,3-b][1]benzofuran-6-yl]-N,N-diphenylaniline
CID 170211894
N,4-diphenyl-N-[4-(6-phenylnaphtho[2,3-b][1]benzofuran-3-yl)phenyl]aniline
CID 169295813
N,N-diphenyl-4-[4-[6-(4-phenylphenyl)naphtho[2,3-b][1]benzofuran-3-yl]phenyl]aniline
CID 169295916
N,N-diphenyl-6-triphenylen-2-ylnaphtho[2,3-b][1]benzofuran-2-amine
CID 169295558
3-(10-naphthalen-2-ylanthracen-9-yl)-6-phenylnaphtho[2,3-b][1]benzofuran
CID 134487576
N-(9,9-dimethylfluoren-2-yl)-6-naphthalen-2-yl-N-triphenylen-2-ylnaphtho[2,3-b][1]benzofuran-3-amine
CID 169296132
6-dibenzofuran-4-yl-N,N-bis(4-phenylphenyl)naphtho[2,3-b][1]benzofuran-3-amine
CID 169296391
N-(9,9-dimethylfluoren-2-yl)-N-phenyl-6-triphenylen-2-ylnaphtho[2,3-b][1]benzofuran-3-amine
CID 169295312
N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-6-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-3-amine
CID 169295552
6-(9,9-dimethylfluoren-2-yl)-N,N-bis(4-phenylphenyl)naphtho[2,3-b][1]benzofuran-3-amine
CID 169296272
N-[4-(1-naphthalen-2-ylnaphthalen-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 176588207
N-[6-(3-naphthalen-2-ylphenyl)naphthalen-2-yl]-N-phenyldibenzofuran-3-amine
CID 174256551

Frequently Asked Questions

What is the IUPAC name of 6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine?
The IUPAC name of 6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine (CID 169295404) is 6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine.
What is the SMILES notation for 6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine?
The canonical SMILES for 6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine is c1ccc(N(c2ccccc2)c2ccc3c(c2)oc2c(-c4ccc5ccccc5c4)c4ccccc4cc23)cc1.
What is the InChIKey of 6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine?
The InChIKey is CPNCVTULUSEBOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25NO/c1-3-14-30(15-4-1)39(31-16-5-2-6-17-31)32-21-22-34-35-24-28-13-9-10-18-33(28)37(38(35)40-36(34)25-32)29-20-19-26-11-7-8-12-27(26)23-29/h1-25H.
What are the key properties of 6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine?
6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine has a molecular weight of 511.62 g/mol, XLogP of 11.03, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-naphthalen-2-yl-N,N-diphenylnaphtho[2,3-b][1]benzofuran-3-amine is sourced from PubChem (CID 169295404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).