9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine

C152H118N10 — CID 159597854

IUPAC9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine
SMILESCC1(C)c2ccccc2N(c2ccc3ccccc3n2)c2ccc(-c3ccc(-c4ccccc4)cc3)cc21.CC1(C)c2ccccc2N(c2cccc(-c3ccc4ccccc4n3)c2)c2ccc(-c3ccccc3)cc21.CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)cc3)cc21.CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(-c4ccccc4)cn3)cc21
InChIInChI=1S/C48H36N4.2C36H28N2.C32H26N2/c1-48(2)41-23-12-13-24-43(41)52(40-21-10-5-11-22-40)44-30-29-38(32-42(44)48)34-27-25-33(26-28-34)37-19-14-20-39(31-37)47-50-45(35-15-6-3-7-16-35)49-46(51-47)36-17-8-4-9-18-36;1-36(2)30-16-7-9-18-34(30)38(35-22-20-27(24-31(35)36)25-11-4-3-5-12-25)29-15-10-14-28(23-29)33-21-19-26-13-6-8-17-32(26)37-33;1-36(2)30-13-7-9-15-33(30)38(35-23-21-28-12-6-8-14-32(28)37-35)34-22-20-29(24-31(34)36)27-18-16-26(17-19-27)25-10-4-3-5-11-25;1-32(2)27-15-9-10-16-30(27)34(26-13-7-4-8-14-26)31-20-18-24(21-28(31)32)29-19-17-25(22-33-29)23-11-5-3-6-12-23/h3-32H,1-2H3;2*3-24H,1-2H3;3-22H,1-2H3
InChIKeyMLBWJIZVMWMNTB-UHFFFAOYSA-N
MW2084.69 g/mol
LogP40.20
Rot. Bonds15

About 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine

9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine (PubChem CID 159597854) has the molecular formula C152H118N10 and a molecular weight of 2084.69 g/mol. Its IUPAC name is 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine.

Molecular Properties

Compound Name9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine
PubChem CID159597854
Molecular FormulaC152H118N10
Molecular Weight2084.69 g/mol
Exact Mass2082.95
IUPAC Name9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine
SMILESCC1(C)c2ccccc2N(c2ccc3ccccc3n2)c2ccc(-c3ccc(-c4ccccc4)cc3)cc21.CC1(C)c2ccccc2N(c2cccc(-c3ccc4ccccc4n3)c2)c2ccc(-c3ccccc3)cc21.CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)cc3)cc21.CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(-c4ccccc4)cn3)cc21
InChIInChI=1S/C48H36N4.2C36H28N2.C32H26N2/c1-48(2)41-23-12-13-24-43(41)52(40-21-10-5-11-22-40)44-30-29-38(32-42(44)48)34-27-25-33(26-28-34)37-19-14-20-39(31-37)47-50-45(35-15-6-3-7-16-35)49-46(51-47)36-17-8-4-9-18-36;1-36(2)30-16-7-9-18-34(30)38(35-22-20-27(24-31(35)36)25-11-4-3-5-12-25)29-15-10-14-28(23-29)33-21-19-26-13-6-8-17-32(26)37-33;1-36(2)30-13-7-9-15-33(30)38(35-23-21-28-12-6-8-14-32(28)37-35)34-22-20-29(24-31(34)36)27-18-16-26(17-19-27)25-10-4-3-5-11-25;1-32(2)27-15-9-10-16-30(27)34(26-13-7-4-8-14-26)31-20-18-24(21-28(31)32)29-19-17-25(22-33-29)23-11-5-3-6-12-23/h3-32H,1-2H3;2*3-24H,1-2H3;3-22H,1-2H3
InChIKeyMLBWJIZVMWMNTB-UHFFFAOYSA-N
XLogP40.20
TPSA90.30 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds15
Heavy Atoms162
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002084.69
LogP ≤ 540.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine?
The IUPAC name of 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine (CID 159597854) is 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine.
What is the SMILES notation for 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine?
The canonical SMILES for 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine is CC1(C)c2ccccc2N(c2ccc3ccccc3n2)c2ccc(-c3ccc(-c4ccccc4)cc3)cc21.CC1(C)c2ccccc2N(c2cccc(-c3ccc4ccccc4n3)c2)c2ccc(-c3ccccc3)cc21.CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)cc3)cc21.CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(-c4ccccc4)cn3)cc21.
What is the InChIKey of 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine?
The InChIKey is MLBWJIZVMWMNTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H36N4.2C36H28N2.C32H26N2/c1-48(2)41-23-12-13-24-43(41)52(40-21-10-5-11-22-40)44-30-29-38(32-42(44)48)34-27-25-33(26-28-34)37-19-14-20-39(31-37)47-50-45(35-15-6-3-7-16-35)49-46(51-47)36-17-8-4-9-18-36;1-36(2)30-16-7-9-18-34(30)38(35-22-20-27(24-31(35)36)25-11-4-3-5-12-25)29-15-10-14-28(23-29)33-21-19-26-13-6-8-17-32(26)37-33;1-36(2)30-13-7-9-15-33(30)38(35-23-21-28-12-6-8-14-32(28)37-35)34-22-20-29(24-31(34)36)27-18-16-26(17-19-27)25-10-4-3-5-11-25;1-32(2)27-15-9-10-16-30(27)34(26-13-7-4-8-14-26)31-20-18-24(21-28(31)32)29-19-17-25(22-33-29)23-11-5-3-6-12-23/h3-32H,1-2H3;2*3-24H,1-2H3;3-22H,1-2H3.
What are the key properties of 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine?
9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine has a molecular weight of 2084.69 g/mol, XLogP of 40.20, 15 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-10-phenyl-2-(5-phenyl-2-pyridinyl)acridine;9,9-dimethyl-2-(4-phenylphenyl)-10-quinolin-2-ylacridine;9,9-dimethyl-2-phenyl-10-(3-quinolin-2-ylphenyl)acridine;2-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-9,9-dimethyl-10-phenylacridine is sourced from PubChem (CID 159597854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).