N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine

C43H29NO — CID 156550128

IUPACN-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine
SMILESc1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2c-3oc3ccccc23)c2cccc3ccccc23)cc1
InChIInChI=1S/C43H29NO/c1-4-17-31(18-5-1)43(32-19-6-2-7-20-32)38-29-34(27-28-36(38)42-41(43)37-24-12-13-26-40(37)45-42)44(33-21-8-3-9-22-33)39-25-14-16-30-15-10-11-23-35(30)39/h1-29H
InChIKeyWCPVWNQOJUSKSI-UHFFFAOYSA-N
MW575.71 g/mol
LogP11.42
Rot. Bonds5

About N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine

N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine (PubChem CID 156550128) has the molecular formula C43H29NO and a molecular weight of 575.71 g/mol. Its IUPAC name is N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine.

Molecular Properties

Compound NameN-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine
PubChem CID156550128
Molecular FormulaC43H29NO
Molecular Weight575.71 g/mol
Exact Mass575.22
IUPAC NameN-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine
SMILESc1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2c-3oc3ccccc23)c2cccc3ccccc23)cc1
InChIInChI=1S/C43H29NO/c1-4-17-31(18-5-1)43(32-19-6-2-7-20-32)38-29-34(27-28-36(38)42-41(43)37-24-12-13-26-40(37)45-42)44(33-21-8-3-9-22-33)39-25-14-16-30-15-10-11-23-35(30)39/h1-29H
InChIKeyWCPVWNQOJUSKSI-UHFFFAOYSA-N
XLogP11.42
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500575.71
LogP ≤ 511.42
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
6-N,16-N-di(dibenzofuran-4-yl)-3,3,19,19-tetramethyl-6-N,16-N-diphenyl-11-oxapentacyclo[10.7.0.02,10.04,9.013,18]nonadeca-1(12),2(10),4(9),5,7,13(18),14,16-octaene-6,16-diamine;3,3,19,19-tetramethyl-6-N,16-N-dinaphthalen-1-yl-6-N,16-N-diphenyl-11-oxapentacyclo[10.7.0.02,10.04,9.013,18]nonadeca-1(12),2(10),4(9),5,7,13(18),14,16-octaene-6,16-diamine
CID 159791448
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
2-N,4-N,4-N-triphenyl-2-N-(9,9'-spirobi[fluorene]-2-yl)spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2,4-diamine
CID 134529625
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
N-[4-(10,10-diphenylindeno[1,2-b][1]benzofuran-3-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 156549425
N-(2,4-diphenylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-2-amine
CID 134551177
N-naphthalen-1-yl-N-phenylspiro[fluorene-9,10'-indeno[1,2-b][1]benzofuran]-4'-amine
CID 134551135
N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine
CID 170400225
N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;2-N-naphthalen-1-yl-2-N,9,9-triphenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine
CID 159926574
4-N-naphthalen-1-yl-4-N-phenyl-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;2-N-naphthalen-1-yl-2-N,9,9-triphenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]benzene-1,4-diamine
CID 158884424
N,4-diphenyl-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;2-N-naphthalen-1-yl-2-N,9,9-triphenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline
CID 161371877

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine?
The IUPAC name of N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine (CID 156550128) is N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine.
What is the SMILES notation for N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine?
The canonical SMILES for N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine is c1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2c-3oc3ccccc23)c2cccc3ccccc23)cc1.
What is the InChIKey of N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine?
The InChIKey is WCPVWNQOJUSKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H29NO/c1-4-17-31(18-5-1)43(32-19-6-2-7-20-32)38-29-34(27-28-36(38)42-41(43)37-24-12-13-26-40(37)45-42)44(33-21-8-3-9-22-33)39-25-14-16-30-15-10-11-23-35(30)39/h1-29H.
What are the key properties of N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine?
N-naphthalen-1-yl-N,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine has a molecular weight of 575.71 g/mol, XLogP of 11.42, 5 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,10,10-triphenylindeno[1,2-b][1]benzofuran-2-amine is sourced from PubChem (CID 156550128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).