5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene

C36H32N2 — CID 143983593

IUPAC5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene
SMILESCC1(C)C2=c3c(c4cc(N5c6ccccc6C(C)(C)c6ccccc65)ccc4n3-c3ccccc31)=CCC2
InChIInChI=1S/C36H32N2/c1-35(2)26-13-5-8-17-31(26)37(32-18-9-6-14-27(32)35)23-20-21-30-25(22-23)24-12-11-16-29-34(24)38(30)33-19-10-7-15-28(33)36(29,3)4/h5-10,12-15,17-22H,11,16H2,1-4H3
InChIKeyZHOUYWRNFRSFQZ-UHFFFAOYSA-N
MW492.67 g/mol
LogP7.76
Rot. Bonds1

About 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene

5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene (PubChem CID 143983593) has the molecular formula C36H32N2 and a molecular weight of 492.67 g/mol. Its IUPAC name is 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene.

Molecular Properties

Compound Name5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene
PubChem CID143983593
Molecular FormulaC36H32N2
Molecular Weight492.67 g/mol
Exact Mass492.26
IUPAC Name5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene
SMILESCC1(C)C2=c3c(c4cc(N5c6ccccc6C(C)(C)c6ccccc65)ccc4n3-c3ccccc31)=CCC2
InChIInChI=1S/C36H32N2/c1-35(2)26-13-5-8-17-31(26)37(32-18-9-6-14-27(32)35)23-20-21-30-25(22-23)24-12-11-16-29-34(24)38(30)33-19-10-7-15-28(33)36(29,3)4/h5-10,12-15,17-22H,11,16H2,1-4H3
InChIKeyZHOUYWRNFRSFQZ-UHFFFAOYSA-N
XLogP7.76
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.67
LogP ≤ 57.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene 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

2-carbazol-9-yl-10-[7-(2-carbazol-9-yl-9,9-dimethylacridin-10-yl)triphenylen-2-yl]-9,9-dimethylacridine
CID 144799051
10-[6-(9,9-dimethyl-3,4-dihydroacridin-10-yl)-9,10-bis(4-methylphenyl)anthracen-2-yl]-9,9-dimethylacridine
CID 89111087
1,4-bis[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenazine
CID 140917933
9,9-dimethyl-10-phenanthren-3-ylacridine
CID 155173536
10-[3,5-di(carbazol-9-yl)phenyl]-9,9-dimethylacridine
CID 58609318
2-(9,9-dimethylacridin-10-yl)-11,11-dimethyl-5-(4-methylphenyl)indeno[1,2-b]carbazole
CID 58501385
5,11,17-tris(9,9-dimethylacridin-10-yl)-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene-8,14-dione
CID 171599918
10-[6-(9,9-dimethylacridin-10-yl)-9,10-dinaphthalen-2-ylanthracen-2-yl]-9,9-dimethylacridine
CID 59219732
2,7-ditert-butyl-10-[6-(2,7-ditert-butyl-9,9-dimethylacridin-10-yl)-9-phenylcarbazol-3-yl]-9,9-dimethylacridine
CID 58384128
10-[6-(9,9-dimethylacridin-10-yl)-9,10-bis[3-(4-phenylphenyl)phenyl]anthracen-2-yl]-9,9-dimethylacridine
CID 59219909
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
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

Frequently Asked Questions

What is the IUPAC name of 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene?
The IUPAC name of 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene (CID 143983593) is 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene.
What is the SMILES notation for 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene?
The canonical SMILES for 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene is CC1(C)C2=c3c(c4cc(N5c6ccccc6C(C)(C)c6ccccc65)ccc4n3-c3ccccc31)=CCC2.
What is the InChIKey of 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene?
The InChIKey is ZHOUYWRNFRSFQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H32N2/c1-35(2)26-13-5-8-17-31(26)37(32-18-9-6-14-27(32)35)23-20-21-30-25(22-23)24-12-11-16-29-34(24)38(30)33-19-10-7-15-28(33)36(29,3)4/h5-10,12-15,17-22H,11,16H2,1-4H3.
What are the key properties of 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene?
5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene has a molecular weight of 492.67 g/mol, XLogP of 7.76, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(9,9-dimethylacridin-10-yl)-13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8,12(20),14,16,18-octaene is sourced from PubChem (CID 143983593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).