2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine

C32H27N5 — CID 138641217

IUPAC2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine
SMILESCc1ccc2c(c1)C(C)(C)c1cc(C)ccc1N2c1ccc2c(c1)c1ncccc1n2-c1cncnc1
InChIInChI=1S/C32H27N5/c1-20-7-10-28-25(14-20)32(3,4)26-15-21(2)8-11-29(26)36(28)22-9-12-27-24(16-22)31-30(6-5-13-35-31)37(27)23-17-33-19-34-18-23/h5-19H,1-4H3
InChIKeyNXZUROYZNZJVOW-UHFFFAOYSA-N
MW481.60 g/mol
LogP7.69
Rot. Bonds2

About 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine

2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine (PubChem CID 138641217) has the molecular formula C32H27N5 and a molecular weight of 481.60 g/mol. Its IUPAC name is 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine.

Molecular Properties

Compound Name2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine
PubChem CID138641217
Molecular FormulaC32H27N5
Molecular Weight481.60 g/mol
Exact Mass481.23
IUPAC Name2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine
SMILESCc1ccc2c(c1)C(C)(C)c1cc(C)ccc1N2c1ccc2c(c1)c1ncccc1n2-c1cncnc1
InChIInChI=1S/C32H27N5/c1-20-7-10-28-25(14-20)32(3,4)26-15-21(2)8-11-29(26)36(28)22-9-12-27-24(16-22)31-30(6-5-13-35-31)37(27)23-17-33-19-34-18-23/h5-19H,1-4H3
InChIKeyNXZUROYZNZJVOW-UHFFFAOYSA-N
XLogP7.69
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500481.60
LogP ≤ 57.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine
CID 138641354
2,7,9,9-tetramethyl-10-(9-methylcarbazol-3-yl)acridine
CID 158231626
2,7-dimethyl-9,9-diphenyl-10-[5-(1,3,5-triazin-2-yl)pyrido[3,2-b]indol-8-yl]acridine;9,9-dimethyl-10-(8-pyridin-3-yl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl)acridine;2,7-dimethyl-10-[5-(1,3,5-triazin-2-yl)pyrido[3,2-b]indol-8-yl]spiro[acridine-9,9'-fluorene];2,7-dimethyl-10-[5-(1,3,5-triazin-2-yl)pyrido[3,2-b]indol-8-yl]spiro[acridine-9,9'-xanthene]
CID 157188681
10-(5-pyridin-3-ylpyrido[3,2-b]indol-8-yl)spiro[acridine-9,9'-fluorene]
CID 138641297
8-methyl-5-(4-phenylphenyl)pyrido[3,2-b]indole
CID 144976361
10-phenyl-10'-(5-pyridin-4-ylpyrido[3,2-b]indol-8-yl)-9,9'-spirobi[acridine]
CID 139574635
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
9-[2-[3,5-bis[5-[3,6-di(carbazol-9-yl)carbazol-9-yl]pyrimidin-2-yl]phenyl]pyrimidin-5-yl]-3,6-di(carbazol-9-yl)carbazole;10-[9-[2-[3,5-bis[5-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]pyrimidin-2-yl]phenyl]pyrimidin-5-yl]carbazol-3-yl]-9,9-dimethylacridine
CID 159694810
8-methyl-5-[3-methyl-4-[2-methyl-4-(8-methylpyrido[3,2-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole
CID 118245939
8-[5-[5-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-3-pyridinyl]pyrido[3,2-b]indol-8-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 118517417
5-(9,9-dimethyl-7-pyrido[3,2-b]indol-5-ylfluoren-2-yl)pyrido[3,2-b]indole
CID 135131175
2-carbazol-9-yl-10-[7-(2-carbazol-9-yl-9,9-dimethylacridin-10-yl)triphenylen-2-yl]-9,9-dimethylacridine
CID 144799051

Frequently Asked Questions

What is the IUPAC name of 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine?
The IUPAC name of 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine (CID 138641217) is 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine.
What is the SMILES notation for 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine?
The canonical SMILES for 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine is Cc1ccc2c(c1)C(C)(C)c1cc(C)ccc1N2c1ccc2c(c1)c1ncccc1n2-c1cncnc1.
What is the InChIKey of 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine?
The InChIKey is NXZUROYZNZJVOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H27N5/c1-20-7-10-28-25(14-20)32(3,4)26-15-21(2)8-11-29(26)36(28)22-9-12-27-24(16-22)31-30(6-5-13-35-31)37(27)23-17-33-19-34-18-23/h5-19H,1-4H3.
What are the key properties of 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine?
2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine has a molecular weight of 481.60 g/mol, XLogP of 7.69, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine is sourced from PubChem (CID 138641217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).