9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine

C31H24N4 — CID 138641354

IUPAC9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine
SMILESCC1(C)c2ccccc2N(c2ccc3c4ncccc4n(-c4cccnc4)c3c2)c2ccccc21
InChIInChI=1S/C31H24N4/c1-31(2)24-10-3-5-12-26(24)34(27-13-6-4-11-25(27)31)21-15-16-23-29(19-21)35(22-9-7-17-32-20-22)28-14-8-18-33-30(23)28/h3-20H,1-2H3
InChIKeyDPKIYHIOGPKZOP-UHFFFAOYSA-N
MW452.56 g/mol
LogP7.68
Rot. Bonds2

About 9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine

9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine (PubChem CID 138641354) has the molecular formula C31H24N4 and a molecular weight of 452.56 g/mol. Its IUPAC name is 9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine.

Molecular Properties

Compound Name9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine
PubChem CID138641354
Molecular FormulaC31H24N4
Molecular Weight452.56 g/mol
Exact Mass452.20
IUPAC Name9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine
SMILESCC1(C)c2ccccc2N(c2ccc3c4ncccc4n(-c4cccnc4)c3c2)c2ccccc21
InChIInChI=1S/C31H24N4/c1-31(2)24-10-3-5-12-26(24)34(27-13-6-4-11-25(27)31)21-15-16-23-29(19-21)35(22-9-7-17-32-20-22)28-14-8-18-33-30(23)28/h3-20H,1-2H3
InChIKeyDPKIYHIOGPKZOP-UHFFFAOYSA-N
XLogP7.68
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.56
LogP ≤ 57.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

10-(5-pyridin-3-ylpyrido[3,2-b]indol-8-yl)spiro[acridine-9,9'-fluorene]
CID 138641297
14-[10-(21,21-dimethyl-10-pyridin-3-yl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaen-14-yl)anthracen-9-yl]-21,21-dimethyl-10-pyridin-3-yl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 139459524
5-pyridin-3-ylpyrido[3,2-b]indole
CID 59459758
6-[2,6-bis(9,9-dimethylacridin-10-yl)carbazol-9-yl]-11-(3-pyridin-3-ylphenyl)phenanthro[9,10-b]pyrazine
CID 118912206
2,7,9,9-tetramethyl-10-(5-pyrimidin-5-ylpyrido[3,2-b]indol-8-yl)acridine
CID 138641217
10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline]
CID 158981211
10-phenyl-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)-9,9'-spirobi[acridine]
CID 139574637
5-(9,9-dimethyl-7-pyrido[3,2-b]indol-5-ylfluoren-2-yl)pyrido[3,2-b]indole
CID 135131175
10-phenyl-10'-(5-pyridin-4-ylpyrido[3,2-b]indol-8-yl)-9,9'-spirobi[acridine]
CID 139574635
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
9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine
CID 138641305
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 9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine?
The IUPAC name of 9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine (CID 138641354) is 9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine.
What is the SMILES notation for 9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine?
The canonical SMILES for 9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine is CC1(C)c2ccccc2N(c2ccc3c4ncccc4n(-c4cccnc4)c3c2)c2ccccc21.
What is the InChIKey of 9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine?
The InChIKey is DPKIYHIOGPKZOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24N4/c1-31(2)24-10-3-5-12-26(24)34(27-13-6-4-11-25(27)31)21-15-16-23-29(19-21)35(22-9-7-17-32-20-22)28-14-8-18-33-30(23)28/h3-20H,1-2H3.
What are the key properties of 9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine?
9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine has a molecular weight of 452.56 g/mol, XLogP of 7.68, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine is sourced from PubChem (CID 138641354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).