2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine

C30H28N2 — CID 158231626

IUPAC2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine
SMILESCc1ccc2c(c1)C(C)(C)c1cc(C)ccc1N2c1ccc2c(c1)c1ccccc1n2C
InChIInChI=1S/C30H28N2/c1-19-10-13-28-24(16-19)30(3,4)25-17-20(2)11-14-29(25)32(28)21-12-15-27-23(18-21)22-8-6-7-9-26(22)31(27)5/h6-18H,1-5H3
InChIKeyZWJUXIZBIOGNSI-UHFFFAOYSA-N
MW416.57 g/mol
LogP8.06
Rot. Bonds1

About 2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine

2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine (PubChem CID 158231626) has the molecular formula C30H28N2 and a molecular weight of 416.57 g/mol. Its IUPAC name is 2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine.

Molecular Properties

Compound Name2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine
PubChem CID158231626
Molecular FormulaC30H28N2
Molecular Weight416.57 g/mol
Exact Mass416.23
IUPAC Name2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine
SMILESCc1ccc2c(c1)C(C)(C)c1cc(C)ccc1N2c1ccc2c(c1)c1ccccc1n2C
InChIInChI=1S/C30H28N2/c1-19-10-13-28-24(16-19)30(3,4)25-17-20(2)11-14-29(25)32(28)21-12-15-27-23(18-21)22-8-6-7-9-26(22)31(27)5/h6-18H,1-5H3
InChIKeyZWJUXIZBIOGNSI-UHFFFAOYSA-N
XLogP8.06
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.57
LogP ≤ 58.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2,7,9,9-tetramethylacridin-10-yl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 140943861
3,7-dimethyl-10-(9-methylcarbazol-3-yl)phenoxazine
CID 158231625
9,9-dimethyl-10-[4-(9-methylcarbazol-3-yl)phenyl]acridine
CID 130353436
2-carbazol-9-yl-10-[7-(2-carbazol-9-yl-9,9-dimethylacridin-10-yl)triphenylen-2-yl]-9,9-dimethylacridine
CID 144799051
5-(2,7-dimethyl-9,9-diphenylacridin-10-yl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 140943868
16,20-dimethyl-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14(19),15,17,21,23-dodecaene
CID 164939565
1,4-bis[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenazine
CID 140917933
2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine
CID 138641217
CID 137451115
CID 137451115
10-(9-diphenylphosphorylcarbazol-3-yl)-9,9-dimethylacridine
CID 140928502
10,10,21,21-tetramethyl-14-(9-phenylcarbazol-3-yl)-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 130450658
2,9,9-trimethyl-10-[4-[4-(2,9,9-trimethylacridin-10-yl)phenyl]sulfonylphenyl]acridine
CID 132504403

Frequently Asked Questions

What is the IUPAC name of 2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine?
The IUPAC name of 2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine (CID 158231626) is 2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine.
What is the SMILES notation for 2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine?
The canonical SMILES for 2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine is Cc1ccc2c(c1)C(C)(C)c1cc(C)ccc1N2c1ccc2c(c1)c1ccccc1n2C.
What is the InChIKey of 2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine?
The InChIKey is ZWJUXIZBIOGNSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28N2/c1-19-10-13-28-24(16-19)30(3,4)25-17-20(2)11-14-29(25)32(28)21-12-15-27-23(18-21)22-8-6-7-9-26(22)31(27)5/h6-18H,1-5H3.
What are the key properties of 2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine?
2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine has a molecular weight of 416.57 g/mol, XLogP of 8.06, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine is sourced from PubChem (CID 158231626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).