10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine

C129H89N9 — CID 160811727

IUPAC10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine
SMILESCC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3cc4c5c(c3)c3ccccc3n5-c3ccccc3N4c3ccccc3)cc21.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccccc4-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)cc3c54)c2)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)c2ccccc2n4-c2ccccc2N3c2ccccc2)cc1
InChIInChI=1S/C48H31N3.C45H33N3.C36H25N3/c1-3-15-32(16-4-1)34-27-35(33-17-5-2-6-18-33)29-36(28-34)50-45-25-13-14-26-46(45)51-44-24-12-9-21-40(44)41-30-37(31-47(50)48(41)51)49-42-22-10-7-19-38(42)39-20-8-11-23-43(39)49;1-45(2)36-20-10-12-22-39(36)46(32-15-5-3-6-16-32)40-26-25-30(28-37(40)45)31-27-35-34-19-9-11-21-38(34)48-42-24-14-13-23-41(42)47(43(29-31)44(35)48)33-17-7-4-8-18-33;1-4-14-26(15-5-1)37(27-16-6-2-7-17-27)29-24-31-30-20-10-11-21-32(30)39-34-23-13-12-22-33(34)38(35(25-29)36(31)39)28-18-8-3-9-19-28/h1-31H;3-29H,1-2H3;1-25H
InChIKeySEJPBVRFBRCLPN-UHFFFAOYSA-N
MW1765.19 g/mol
LogP35.38
Rot. Bonds11

About 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine

10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine (PubChem CID 160811727) has the molecular formula C129H89N9 and a molecular weight of 1765.19 g/mol. Its IUPAC name is 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine.

Molecular Properties

Compound Name10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine
PubChem CID160811727
Molecular FormulaC129H89N9
Molecular Weight1765.19 g/mol
Exact Mass1763.72
IUPAC Name10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine
SMILESCC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3cc4c5c(c3)c3ccccc3n5-c3ccccc3N4c3ccccc3)cc21.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccccc4-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)cc3c54)c2)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)c2ccccc2n4-c2ccccc2N3c2ccccc2)cc1
InChIInChI=1S/C48H31N3.C45H33N3.C36H25N3/c1-3-15-32(16-4-1)34-27-35(33-17-5-2-6-18-33)29-36(28-34)50-45-25-13-14-26-46(45)51-44-24-12-9-21-40(44)41-30-37(31-47(50)48(41)51)49-42-22-10-7-19-38(42)39-20-8-11-23-43(39)49;1-45(2)36-20-10-12-22-39(36)46(32-15-5-3-6-16-32)40-26-25-30(28-37(40)45)31-27-35-34-19-9-11-21-38(34)48-42-24-14-13-23-41(42)47(43(29-31)44(35)48)33-17-7-4-8-18-33;1-4-14-26(15-5-1)37(27-16-6-2-7-17-27)29-24-31-30-20-10-11-21-32(30)39-34-23-13-12-22-33(34)38(35(25-29)36(31)39)28-18-8-3-9-19-28/h1-31H;3-29H,1-2H3;1-25H
InChIKeySEJPBVRFBRCLPN-UHFFFAOYSA-N
XLogP35.38
TPSA35.92 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds11
Heavy Atoms138
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001765.19
LogP ≤ 535.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine with MolForge

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Related Compounds

10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;21,21-dimethyl-N,N-diphenyl-2,14-diazaheptacyclo[12.11.1.12,9.03,8.015,20.022,26.013,27]heptacosa-1(25),3,5,7,9(27),10,12,15,17,19,22(26),23-dodecaen-11-amine;N-(9,9-dimethylfluoren-2-yl)-13,13-dimethyl-N-phenyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-5-amine
CID 160871548
4-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-[4-(8,8,14,14-tetramethyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-yl)phenyl]phenyl]aniline
CID 90201353
4-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(8,8,14,14-tetramethyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-yl)phenyl]aniline
CID 90201363
10-[3,5-bis(4-carbazol-9-ylphenyl)phenyl]-9,9-dimethylacridine;9-[3-carbazol-9-yl-5-(4-carbazol-9-ylphenyl)phenyl]carbazole;10-[3,5-di(carbazol-9-yl)phenyl]-9,9-dimethylacridine;9-[4-(3,5-diphenylphenyl)phenyl]carbazole
CID 160816832
10-[3-[4-[3-(9,9-dimethyl-10-phenylacridin-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene
CID 170682872
5-(13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-yl)-1-N,3-N-diphenyl-1-N,3-N-bis(6-phenylnaphthalen-2-yl)benzene-1,3-diamine
CID 88873421
10-[4-(3-carbazol-9-ylphenyl)phenyl]-9,9-dimethylacridine
CID 169006724
4-(9,9-dimethyl-10-phenylacridin-3-yl)-N,N-diphenylaniline
CID 121258967
2-(9,9-dimethyl-10-phenylacridin-3-yl)-N-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 121259166
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
10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,9-dimethyl-2-(9-phenylcarbazol-3-yl)acridine
CID 118528312
5-(9,9-dimethyl-10-phenylacridin-2-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene
CID 67326458

Frequently Asked Questions

What is the IUPAC name of 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine?
The IUPAC name of 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine (CID 160811727) is 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine.
What is the SMILES notation for 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine?
The canonical SMILES for 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine is CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3cc4c5c(c3)c3ccccc3n5-c3ccccc3N4c3ccccc3)cc21.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccccc4-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)cc3c54)c2)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)c2ccccc2n4-c2ccccc2N3c2ccccc2)cc1.
What is the InChIKey of 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine?
The InChIKey is SEJPBVRFBRCLPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H31N3.C45H33N3.C36H25N3/c1-3-15-32(16-4-1)34-27-35(33-17-5-2-6-18-33)29-36(28-34)50-45-25-13-14-26-46(45)51-44-24-12-9-21-40(44)41-30-37(31-47(50)48(41)51)49-42-22-10-7-19-38(42)39-20-8-11-23-43(39)49;1-45(2)36-20-10-12-22-39(36)46(32-15-5-3-6-16-32)40-26-25-30(28-37(40)45)31-27-35-34-19-9-11-21-38(34)48-42-24-14-13-23-41(42)47(43(29-31)44(35)48)33-17-7-4-8-18-33;1-4-14-26(15-5-1)37(27-16-6-2-7-17-27)29-24-31-30-20-10-11-21-32(30)39-34-23-13-12-22-33(34)38(35(25-29)36(31)39)28-18-8-3-9-19-28/h1-31H;3-29H,1-2H3;1-25H.
What are the key properties of 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine?
10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine has a molecular weight of 1765.19 g/mol, XLogP of 35.38, 11 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 10-carbazol-9-yl-13-(3,5-diphenylphenyl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(9,9-dimethyl-10-phenylacridin-2-yl)-13-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;N,N,13-triphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-amine is sourced from PubChem (CID 160811727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).