7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine

C43H30N2 — CID 171755217

IUPAC7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)-c3ccc(C5=Nc6ccccc6C5)cc3C4)c3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/C43H30N2/c1-2-8-29(9-3-1)31-14-19-37(20-15-31)45(38-21-16-30-10-4-5-11-32(30)26-38)39-22-17-33-24-36-25-35(18-23-40(36)41(33)28-39)43-27-34-12-6-7-13-42(34)44-43/h1-23,25-26,28H,24,27H2
InChIKeyNBWIVNJEWLFQRZ-UHFFFAOYSA-N
MW574.73 g/mol
LogP11.22
Rot. Bonds5

About 7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine

7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine (PubChem CID 171755217) has the molecular formula C43H30N2 and a molecular weight of 574.73 g/mol. Its IUPAC name is 7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine.

Molecular Properties

Compound Name7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine
PubChem CID171755217
Molecular FormulaC43H30N2
Molecular Weight574.73 g/mol
Exact Mass574.24
IUPAC Name7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)-c3ccc(C5=Nc6ccccc6C5)cc3C4)c3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/C43H30N2/c1-2-8-29(9-3-1)31-14-19-37(20-15-31)45(38-21-16-30-10-4-5-11-32(30)26-38)39-22-17-33-24-36-25-35(18-23-40(36)41(33)28-39)43-27-34-12-6-7-13-42(34)44-43/h1-23,25-26,28H,24,27H2
InChIKeyNBWIVNJEWLFQRZ-UHFFFAOYSA-N
XLogP11.22
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.73
LogP ≤ 511.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline
CID 146386867
N-[4-[4-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 59029881
N-(2-naphthalen-1-ylnaphthalen-1-yl)-N-(4-phenylphenyl)-9H-fluoren-3-amine
CID 176588293
9-(3H-indol-2-yl)-N-(6-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-5-amine
CID 171754416
3-(3H-indol-2-yl)-N-(4-naphthalen-2-ylphenyl)-N-(4-phenylphenyl)naphtho[2,3-b][1]benzothiol-1-amine
CID 171754697
4-(9H-fluoren-3-yl)-N,N-diphenylaniline
CID 157436916
N,N-diphenyl-4-(6-phenyl-9H-fluoren-3-yl)aniline
CID 158121495
7-N,19-N-dinaphthalen-2-yl-7-N,19-N-bis(4-phenylphenyl)-10-oxahexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1(24),2,4(9),5,7,11,13,15(23),16(21),17,19-undecaene-7,19-diamine
CID 174334823
N,N-bis[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]naphthalen-2-amine;N,N-diphenyl-4-[4-(N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]aniline
CID 160607838
N-[4-[4-[4-[4-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 58905935
N,N-diphenyl-9H-fluoren-2-amine
CID 20734444
N-naphthalen-2-yl-N-[4-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]phenyl]-9H-fluoren-3-amine
CID 156524719

Frequently Asked Questions

What is the IUPAC name of 7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine?
The IUPAC name of 7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine (CID 171755217) is 7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine.
What is the SMILES notation for 7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine?
The canonical SMILES for 7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)-c3ccc(C5=Nc6ccccc6C5)cc3C4)c3ccc4ccccc4c3)cc2)cc1.
What is the InChIKey of 7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine?
The InChIKey is NBWIVNJEWLFQRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H30N2/c1-2-8-29(9-3-1)31-14-19-37(20-15-31)45(38-21-16-30-10-4-5-11-32(30)26-38)39-22-17-33-24-36-25-35(18-23-40(36)41(33)28-39)43-27-34-12-6-7-13-42(34)44-43/h1-23,25-26,28H,24,27H2.
What are the key properties of 7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine?
7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine has a molecular weight of 574.73 g/mol, XLogP of 11.22, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3H-indol-2-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)-9H-fluoren-3-amine is sourced from PubChem (CID 171755217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).