N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine

C43H27NO — CID 134551135

IUPACN-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine
SMILESc1ccc(N(c2cccc3c2-c2oc4ccccc4c2C32c3ccccc3-c3ccccc32)c2cccc3ccccc23)cc1
InChIInChI=1S/C43H27NO/c1-2-16-29(17-3-1)44(37-25-12-15-28-14-4-5-18-30(28)37)38-26-13-24-36-40(38)42-41(33-21-8-11-27-39(33)45-42)43(36)34-22-9-6-19-31(34)32-20-7-10-23-35(32)43/h1-27H
InChIKeySLAJPQDGKOMJGF-UHFFFAOYSA-N
MW573.70 g/mol
LogP11.40
Rot. Bonds3

About N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine

N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine (PubChem CID 134551135) has the molecular formula C43H27NO and a molecular weight of 573.70 g/mol. Its IUPAC name is N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine.

Molecular Properties

Compound NameN-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine
PubChem CID134551135
Molecular FormulaC43H27NO
Molecular Weight573.70 g/mol
Exact Mass573.21
IUPAC NameN-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine
SMILESc1ccc(N(c2cccc3c2-c2oc4ccccc4c2C32c3ccccc3-c3ccccc32)c2cccc3ccccc23)cc1
InChIInChI=1S/C43H27NO/c1-2-16-29(17-3-1)44(37-25-12-15-28-14-4-5-18-30(28)37)38-26-13-24-36-40(38)42-41(33-21-8-11-27-39(33)45-42)43(36)34-22-9-6-19-31(34)32-20-7-10-23-35(32)43/h1-27H
InChIKeySLAJPQDGKOMJGF-UHFFFAOYSA-N
XLogP11.40
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500573.70
LogP ≤ 511.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-naphthalen-1-yl-N-(4-phenylphenyl)spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2'-amine
CID 134551139
2-N'-naphthalen-2-yl-2-N,2-N-diphenyl-2-N'-(4-phenylphenyl)spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2,2'-diamine;2-N-naphthalen-2-yl-2-N,4-N',4-N'-triphenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2,4'-diamine;2-N,2-N,5-N,5-N-tetraphenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2,5-diamine;2-N',2-N',4-N-triphenyl-4-N-(4-phenylphenyl)spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2',4-diamine
CID 159110697
4-carbazol-9-yl-N,N-diphenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine
CID 134529861
N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-1'-amine
CID 134551151
N-phenyl-N-[2-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine
CID 170526305
N-(4-phenylphenyl)-N-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-yldibenzofuran-1-amine
CID 121391790
N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine
CID 156550128
N-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)naphtho[2,1-b][1]benzofuran-10-amine
CID 170272344
3-N-(9,9-dimethylfluoren-2-yl)-3-N,4-N',4-N'-triphenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-3,4'-diamine;3-N',4-N-diphenyl-3-N',4-N-bis(4-phenylphenyl)spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-3',4-diamine;2-N-(4-naphthalen-1-ylphenyl)-1-N',1-N',2-N-triphenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-1',2-diamine
CID 159234703
N-dibenzofuran-4-yl-2-[dibenzothiophen-2-yl(phenyl)methyl]-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine
CID 170215404
N-(2-dibenzofuran-1-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-4-amine
CID 176583278
11-N',17-N'-dinaphthalen-1-yl-11-N',17-N'-diphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine
CID 130262417

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine?
The IUPAC name of N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine (CID 134551135) is N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine.
What is the SMILES notation for N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine?
The canonical SMILES for N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine is c1ccc(N(c2cccc3c2-c2oc4ccccc4c2C32c3ccccc3-c3ccccc32)c2cccc3ccccc23)cc1.
What is the InChIKey of N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine?
The InChIKey is SLAJPQDGKOMJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H27NO/c1-2-16-29(17-3-1)44(37-25-12-15-28-14-4-5-18-30(28)37)38-26-13-24-36-40(38)42-41(33-21-8-11-27-39(33)45-42)43(36)34-22-9-6-19-31(34)32-20-7-10-23-35(32)43/h1-27H.
What are the key properties of N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine?
N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine has a molecular weight of 573.70 g/mol, XLogP of 11.40, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine is sourced from PubChem (CID 134551135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).