N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine

C37H23NO2 — CID 166960056

IUPACN-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine
SMILESc1ccc2c(c1)Oc1ccccc1C21c2ccccc2-c2c(Nc3ccc4oc5ccccc5c4c3)cccc21
InChIInChI=1S/C37H23NO2/c1-3-12-27-25(11-1)36-30(37(27)28-13-4-7-18-34(28)40-35-19-8-5-14-29(35)37)15-9-16-31(36)38-23-20-21-33-26(22-23)24-10-2-6-17-32(24)39-33/h1-22,38H
InChIKeyIPCPZDPDCATEAS-UHFFFAOYSA-N
MW513.60 g/mol
LogP9.80
Rot. Bonds2

About N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine

N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine (PubChem CID 166960056) has the molecular formula C37H23NO2 and a molecular weight of 513.60 g/mol. Its IUPAC name is N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine.

Molecular Properties

Compound NameN-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine
PubChem CID166960056
Molecular FormulaC37H23NO2
Molecular Weight513.60 g/mol
Exact Mass513.17
IUPAC NameN-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine
SMILESc1ccc2c(c1)Oc1ccccc1C21c2ccccc2-c2c(Nc3ccc4oc5ccccc5c4c3)cccc21
InChIInChI=1S/C37H23NO2/c1-3-12-27-25(11-1)36-30(37(27)28-13-4-7-18-34(28)40-35-19-8-5-14-29(35)37)15-9-16-31(36)38-23-20-21-33-26(22-23)24-10-2-6-17-32(24)39-33/h1-22,38H
InChIKeyIPCPZDPDCATEAS-UHFFFAOYSA-N
XLogP9.80
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.60
LogP ≤ 59.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-dibenzofuran-2-ylphenyl)-9,9'-spirobi[fluorene]-4-amine;N-(4-phenylnaphthalen-1-yl)-9,9'-spirobi[fluorene]-4-amine;N-[3-(3-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-4-amine
CID 160799139
N-(3-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-4-amine
CID 139568225
N-dibenzofuran-1-yldibenzofuran-2-amine
CID 164743454
N-(4-phenyldibenzofuran-1-yl)spiro[fluorene-9,9'-xanthene]-2-amine
CID 169305180
N-dibenzofuran-2-yl-N-spiro[fluorene-9,9'-xanthene]-2-ylspiro[fluorene-9,9'-xanthene]-2-amine
CID 138476872
N-dibenzofuran-4-ylspiro[fluorene-9,9'-xanthene]-4'-amine
CID 169305044
8-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)dibenzofuran-4-amine
CID 172545015
N-dibenzofuran-4-yl-9,9-dimethylxanthen-3-amine
CID 168806172
9-phenyl-N-spiro[fluorene-9,9'-xanthene]-4-ylcarbazol-1-amine
CID 169305047
9-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine
CID 146332882
N-dibenzofuran-3-yl-N-phenylspiro[9-oxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene-14,9'-xanthene]-4-amine
CID 162771468
N-dibenzofuran-3-yl-N-phenylspiro[fluoreno[4,3-b][1]benzofuran-7,9'-xanthene]-3-amine
CID 162771437

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine?
The IUPAC name of N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine (CID 166960056) is N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine.
What is the SMILES notation for N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine?
The canonical SMILES for N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine is c1ccc2c(c1)Oc1ccccc1C21c2ccccc2-c2c(Nc3ccc4oc5ccccc5c4c3)cccc21.
What is the InChIKey of N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine?
The InChIKey is IPCPZDPDCATEAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H23NO2/c1-3-12-27-25(11-1)36-30(37(27)28-13-4-7-18-34(28)40-35-19-8-5-14-29(35)37)15-9-16-31(36)38-23-20-21-33-26(22-23)24-10-2-6-17-32(24)39-33/h1-22,38H.
What are the key properties of N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine?
N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine has a molecular weight of 513.60 g/mol, XLogP of 9.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-2-ylspiro[fluorene-9,9'-xanthene]-4-amine is sourced from PubChem (CID 166960056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).