N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine

C59H40N2 — CID 146508842

IUPACN,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine
SMILESc1ccc(-c2c3c4c(-c5cccc(N(c6ccccc6)c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c5)cccc4ccc3n3ccccc23)cc1
InChIInChI=1S/C59H40N2/c1-5-19-41(20-6-1)57-54-33-15-16-38-60(54)55-37-34-42-21-18-31-49(56(42)58(55)57)43-22-17-29-47(39-43)61(46-27-11-4-12-28-46)48-35-36-51-50-30-13-14-32-52(50)59(53(51)40-48,44-23-7-2-8-24-44)45-25-9-3-10-26-45/h1-40H
InChIKeyCRONYGHIJGLJIH-UHFFFAOYSA-N
MW776.98 g/mol
LogP15.41
Rot. Bonds7

About N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine

N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine (PubChem CID 146508842) has the molecular formula C59H40N2 and a molecular weight of 776.98 g/mol. Its IUPAC name is N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine.

Molecular Properties

Compound NameN,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine
PubChem CID146508842
Molecular FormulaC59H40N2
Molecular Weight776.98 g/mol
Exact Mass776.32
IUPAC NameN,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine
SMILESc1ccc(-c2c3c4c(-c5cccc(N(c6ccccc6)c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c5)cccc4ccc3n3ccccc23)cc1
InChIInChI=1S/C59H40N2/c1-5-19-41(20-6-1)57-54-33-15-16-38-60(54)55-37-34-42-21-18-31-49(56(42)58(55)57)43-22-17-29-47(39-43)61(46-27-11-4-12-28-46)48-35-36-51-50-30-13-14-32-52(50)59(53(51)40-48,44-23-7-2-8-24-44)45-25-9-3-10-26-45/h1-40H
InChIKeyCRONYGHIJGLJIH-UHFFFAOYSA-N
XLogP15.41
TPSA7.65 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500776.98
LogP ≤ 515.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-naphthalen-2-yl-9,9-diphenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]fluoren-2-amine
CID 146508899
N,9,9-triphenyl-N-[4-(21-phenyl-15-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,16,18,20-decaen-4-yl)phenyl]fluoren-2-amine
CID 146508618
N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-15-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8(13),9,11,16,18,20-decaen-11-yl)aniline;N-(4-naphthalen-1-ylphenyl)-N-[4-[4-(21-phenyl-15-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8(13),9,11,16,18,20-decaen-11-yl)phenyl]phenyl]dibenzofuran-1-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(21-phenyl-15-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8(13),9,11,16,18,20-decaen-11-yl)phenyl]-4-(4-phenylphenyl)aniline;N,9,9-triphenyl-N-[3-[4-(21-phenyl-15-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8(13),9,11,16,18,20-decaen-11-yl)phenyl]phenyl]fluoren-2-amine
CID 162017725
N-[4-[4-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine
CID 166565630
N-(3-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 167323845
N-(3-naphtho[2,1-b][1]benzothiol-1-ylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 168807272
N-(9,9-diphenylfluoren-2-yl)-N,5'-diphenylspiro[benzo[a]phenalene-7,9'-fluorene]-2'-amine
CID 168812075
N-phenanthren-2-yl-N-[4-[3-[4-(21-phenyl-15-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8(13),9,11,16,18,20-decaen-11-yl)phenyl]phenyl]phenyl]dibenzothiophen-2-amine;4-phenyl-N-[4-[4-[4-(21-phenyl-15-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8(13),9,11,16,18,20-decaen-11-yl)phenyl]phenyl]phenyl]-N-[4-(2-phenylphenyl)phenyl]aniline;N,9,9-triphenyl-N-[3-[4-(21-phenyl-15-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8(13),9,11,16,18,20-decaen-11-yl)phenyl]phenyl]fluoren-2-amine
CID 161243303
N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 86198899
N,9,9-triphenyl-N-[4-(8-phenylphenanthren-9-yl)phenyl]fluoren-2-amine
CID 146631646
N-[3-[3-[3-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-9,9-diphenyl-N-(3-phenylnaphthalen-2-yl)fluoren-2-amine
CID 177098438
N-(9,9-diphenylfluoren-2-yl)-N-phenylspiro[benzo[b]fluorene-11,9'-fluorene]-2-amine
CID 134193981

Frequently Asked Questions

What is the IUPAC name of N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine?
The IUPAC name of N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine (CID 146508842) is N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine.
What is the SMILES notation for N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine?
The canonical SMILES for N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine is c1ccc(-c2c3c4c(-c5cccc(N(c6ccccc6)c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c5)cccc4ccc3n3ccccc23)cc1.
What is the InChIKey of N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine?
The InChIKey is CRONYGHIJGLJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H40N2/c1-5-19-41(20-6-1)57-54-33-15-16-38-60(54)55-37-34-42-21-18-31-49(56(42)58(55)57)43-22-17-29-47(39-43)61(46-27-11-4-12-28-46)48-35-36-51-50-30-13-14-32-52(50)59(53(51)40-48,44-23-7-2-8-24-44)45-25-9-3-10-26-45/h1-40H.
What are the key properties of N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine?
N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine has a molecular weight of 776.98 g/mol, XLogP of 15.41, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,9,9-triphenyl-N-[3-(12-phenylnaphtho[1,2-b]indolizin-1-yl)phenyl]fluoren-2-amine is sourced from PubChem (CID 146508842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).