10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine

C69H51N5 — CID 154589764

IUPAC10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine
SMILESCC1(C)c2ccccc2N(c2cc(N3c4ccccc4C(c4ccccc4)(c4ccccc4)c4ccncc43)cc(-n3c4ccccc4c4ccccc43)c2)c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C69H51N5/c1-68(2)58-33-17-21-37-64(58)73(66-40-39-52(46-61(66)68)71(50-27-11-5-12-28-50)51-29-13-6-14-30-51)54-43-53(72-62-35-19-15-31-56(62)57-32-16-20-36-63(57)72)44-55(45-54)74-65-38-22-18-34-59(65)69(48-23-7-3-8-24-48,49-25-9-4-10-26-49)60-41-42-70-47-67(60)74/h3-47H,1-2H3
InChIKeyUGZLBJWHNQZKJF-UHFFFAOYSA-N
MW950.20 g/mol
LogP17.92
Rot. Bonds8

About 10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine

10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine (PubChem CID 154589764) has the molecular formula C69H51N5 and a molecular weight of 950.20 g/mol. Its IUPAC name is 10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine.

Molecular Properties

Compound Name10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine
PubChem CID154589764
Molecular FormulaC69H51N5
Molecular Weight950.20 g/mol
Exact Mass949.41
IUPAC Name10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine
SMILESCC1(C)c2ccccc2N(c2cc(N3c4ccccc4C(c4ccccc4)(c4ccccc4)c4ccncc43)cc(-n3c4ccccc4c4ccccc43)c2)c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C69H51N5/c1-68(2)58-33-17-21-37-64(58)73(66-40-39-52(46-61(66)68)71(50-27-11-5-12-28-50)51-29-13-6-14-30-51)54-43-53(72-62-35-19-15-31-56(62)57-32-16-20-36-63(57)72)44-55(45-54)74-65-38-22-18-34-59(65)69(48-23-7-3-8-24-48,49-25-9-4-10-26-49)60-41-42-70-47-67(60)74/h3-47H,1-2H3
InChIKeyUGZLBJWHNQZKJF-UHFFFAOYSA-N
XLogP17.92
TPSA27.54 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms74
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500950.20
LogP ≤ 517.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

10-[4-carbazol-9-yl-6-(2-carbazol-9-yl-9,9-dimethylacridin-10-yl)-2-pyridinyl]-5,5-diphenylbenzo[b][1,7]naphthyridine;10-[4-carbazol-9-yl-6-(9,9-dimethylacridin-10-yl)-2-pyridinyl]-5,5-diphenylbenzo[b][1,7]naphthyridine;10-[4-carbazol-9-yl-6-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)-2-pyridinyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine;10-[6-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)-2-pyridinyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine
CID 159656769
9-[6-(5,5-dimethylbenzo[b][1,7]naphthyridin-10-yl)-2-pyridinyl]-N,N-diphenylcarbazol-3-amine
CID 154589708
10-[4,6-di(carbazol-9-yl)-2-pyridinyl]-5,5-diphenylbenzo[b][1,7]naphthyridine
CID 154589746
N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-3-(9,9,10-triphenylacridin-3-yl)aniline;N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-3-(9,9,10-triphenylacridin-3-yl)aniline;N-phenyl-3-(9-phenylcarbazol-3-yl)-N-[3-(9,9,10-triphenylacridin-3-yl)phenyl]aniline;N-(4-phenylphenyl)-N-(4-pyridin-4-ylphenyl)-3-(9,9,10-triphenylacridin-3-yl)aniline
CID 159826342
10-[3,5-di(carbazol-9-yl)phenyl]-9,9-dimethylacridine
CID 58609318
10-[4,6-bis(3-carbazol-9-ylcarbazol-9-yl)-2-pyridinyl]-5,5-diphenylbenzo[b][1,7]naphthyridine
CID 154589727
24,24-dimethyl-N,N-diphenyl-17-pyridin-3-yl-17-azahexacyclo[12.12.0.02,7.08,13.016,25.018,23]hexacosa-1(26),2,4,6,8,10,12,14,16(25),18(23),19,21-dodecaen-21-amine
CID 144635152
N-(9,9-dimethylfluoren-2-yl)-13,13-dimethyl-N-(4-phenylphenyl)-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine;10-(9,9-diphenylacridin-10-yl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaene;10-(3,6-diphenylcarbazol-9-yl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaene
CID 161390341
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[3-(9,9,10-triphenylacridin-3-yl)phenyl]fluoren-2-amine;9-phenyl-N-(4-phenylphenyl)-N-[3-(9,9,10-triphenylacridin-3-yl)phenyl]carbazol-3-amine;N-(4-phenylphenyl)-N-(4-pyridin-2-ylphenyl)-3-(9,9,10-triphenylacridin-3-yl)aniline;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-3-(9,9,10-triphenylacridin-3-yl)aniline
CID 160790568
2-(9,9-dimethyl-10-phenylacridin-3-yl)-N-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]aniline;2-(9,9-dimethyl-10-phenylacridin-3-yl)-N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N,N,9,9,10-pentakis-phenylacridin-3-amine;9,9,10-triphenyl-N,N-bis(4-phenylphenyl)acridin-3-amine
CID 159220979
9-[5-(9,9-dimethylacridin-10-yl)-2-(N-phenylanilino)phenyl]-N,N-diphenylcarbazol-3-amine
CID 90061389
4-[9,9-dimethyl-2-(9-phenylfluoren-9-yl)acridin-10-yl]-N,N-diphenylaniline
CID 167214969

Frequently Asked Questions

What is the IUPAC name of 10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine?
The IUPAC name of 10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine (CID 154589764) is 10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine.
What is the SMILES notation for 10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine?
The canonical SMILES for 10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine is CC1(C)c2ccccc2N(c2cc(N3c4ccccc4C(c4ccccc4)(c4ccccc4)c4ccncc43)cc(-n3c4ccccc4c4ccccc43)c2)c2ccc(N(c3ccccc3)c3ccccc3)cc21.
What is the InChIKey of 10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine?
The InChIKey is UGZLBJWHNQZKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H51N5/c1-68(2)58-33-17-21-37-64(58)73(66-40-39-52(46-61(66)68)71(50-27-11-5-12-28-50)51-29-13-6-14-30-51)54-43-53(72-62-35-19-15-31-56(62)57-32-16-20-36-63(57)72)44-55(45-54)74-65-38-22-18-34-59(65)69(48-23-7-3-8-24-48,49-25-9-4-10-26-49)60-41-42-70-47-67(60)74/h3-47H,1-2H3.
What are the key properties of 10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine?
10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine has a molecular weight of 950.20 g/mol, XLogP of 17.92, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-carbazol-9-yl-5-(5,5-diphenylbenzo[b][1,7]naphthyridin-10-yl)phenyl]-9,9-dimethyl-N,N-diphenylacridin-2-amine is sourced from PubChem (CID 154589764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).