1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine

C33H30N2O2 — CID 154630858

IUPAC1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine
SMILESCOc1cccc2c1C(c1cccc3ccccc13)c1c(OC)cc(N(C)C)cc1N2c1ccccc1
InChIInChI=1S/C33H30N2O2/c1-34(2)24-20-28-33(30(21-24)37-4)31(26-17-10-13-22-12-8-9-16-25(22)26)32-27(18-11-19-29(32)36-3)35(28)23-14-6-5-7-15-23/h5-21,31H,1-4H3
InChIKeyBGNBBGASPCGDOX-UHFFFAOYSA-N
MW486.62 g/mol
LogP7.89
Rot. Bonds5

About 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine

1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine (PubChem CID 154630858) has the molecular formula C33H30N2O2 and a molecular weight of 486.62 g/mol. Its IUPAC name is 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine.

Molecular Properties

Compound Name1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine
PubChem CID154630858
Molecular FormulaC33H30N2O2
Molecular Weight486.62 g/mol
Exact Mass486.23
IUPAC Name1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine
SMILESCOc1cccc2c1C(c1cccc3ccccc13)c1c(OC)cc(N(C)C)cc1N2c1ccccc1
InChIInChI=1S/C33H30N2O2/c1-34(2)24-20-28-33(30(21-24)37-4)31(26-17-10-13-22-12-8-9-16-25(22)26)32-27(18-11-19-29(32)36-3)35(28)23-14-6-5-7-15-23/h5-21,31H,1-4H3
InChIKeyBGNBBGASPCGDOX-UHFFFAOYSA-N
XLogP7.89
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.62
LogP ≤ 57.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine 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

(1S)-1-[3,5-bis(trifluoromethyl)phenyl]-3,19-dimethoxy-8-propyl-14-(2,4,6-trimethylphenyl)-8,14-diazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene
CID 139043031
9-(4-fluorophenyl)-1,8-dimethoxy-10-phenyl-9H-acridine
CID 168341159
1-[3-(4-Methoxyphenyl)-3-[4-methoxy-3-(trifluoromethyl)phenyl]benzo[f]chromen-6-yl]piperidine
CID 22624733
6-fluoro-1-N,3-N-bis(3-methoxyphenyl)-4-methyl-1-N,3-N-bis(4-methylphenyl)naphthalene-1,3-diamine
CID 22900163
1-[3-(3-fluoro-4-methoxyphenyl)-3-[4-(methoxymethyl)phenyl]benzo[f]chromen-6-yl]-3,4-dihydro-2H-quinoline
CID 23228086
16-N-(2-fluoro-4,6-diphenylphenyl)-5-N-[(2Z,4Z)-hexa-2,4-dienyl]-5-N-naphthalen-2-yl-16-N-phenyl-8,19-dioxahexacyclo[10.10.2.02,7.09,23.013,18.020,24]tetracosa-1(23),2(7),3,5,9,11,13(18),14,16,20(24),21-undecaene-5,16-diamine
CID 118027820
4-[4-(N-(2-fluoro-4,6-diphenylphenyl)anilino)phenyl]-N,N-diphenyl-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaen-17-amine
CID 118148982
N-(2-fluoro-4,6-diphenylphenyl)-N-phenyl-4-[4-(N-phenylanilino)phenyl]-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaen-17-amine
CID 118148987
N-(2-fluoro-4,6-diphenylphenyl)-N-phenyl-4-[4-(N-(2-phenylphenyl)anilino)phenyl]-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaen-17-amine
CID 118148993
N-(2-fluoro-4,6-diphenylphenyl)-N-phenyl-16-[4-(N-phenylanilino)phenyl]-8-oxapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(21),2(7),3,5,9,11,13,15,17,19-decaen-5-amine
CID 121295913
N-(2-fluoro-4,6-diphenylphenyl)-N-phenyl-16-[4-(N-(2-phenylphenyl)anilino)phenyl]-8-oxapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(21),2(7),3,5,9,11,13,15,17,19-decaen-5-amine
CID 121295923
14-N-(2-fluoro-6-phenylphenyl)-5-N,5-N,14-N-triphenyl-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine
CID 122473575

Frequently Asked Questions

What is the IUPAC name of 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine?
The IUPAC name of 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine (CID 154630858) is 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine.
What is the SMILES notation for 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine?
The canonical SMILES for 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine is COc1cccc2c1C(c1cccc3ccccc13)c1c(OC)cc(N(C)C)cc1N2c1ccccc1.
What is the InChIKey of 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine?
The InChIKey is BGNBBGASPCGDOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H30N2O2/c1-34(2)24-20-28-33(30(21-24)37-4)31(26-17-10-13-22-12-8-9-16-25(22)26)32-27(18-11-19-29(32)36-3)35(28)23-14-6-5-7-15-23/h5-21,31H,1-4H3.
What are the key properties of 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine?
1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine has a molecular weight of 486.62 g/mol, XLogP of 7.89, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-dimethoxy-N,N-dimethyl-9-naphthalen-1-yl-10-phenyl-9H-acridin-3-amine is sourced from PubChem (CID 154630858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).