2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene

C33H20N2 — CID 134962306

IUPAC2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene
SMILESc1ccc2c(-c3cc4cncc5cc(-c6cccc7ccccc67)c6ccc3n6c45)cccc2c1
InChIInChI=1S/C33H20N2/c1-3-11-25-21(7-1)9-5-13-27(25)29-17-23-19-34-20-24-18-30(32-16-15-31(29)35(32)33(23)24)28-14-6-10-22-8-2-4-12-26(22)28/h1-20H
InChIKeyIJLGYLALOYZUOI-UHFFFAOYSA-N
MW444.54 g/mol
LogP8.72
Rot. Bonds2

About 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene

2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene (PubChem CID 134962306) has the molecular formula C33H20N2 and a molecular weight of 444.54 g/mol. Its IUPAC name is 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene.

Molecular Properties

Compound Name2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene
PubChem CID134962306
Molecular FormulaC33H20N2
Molecular Weight444.54 g/mol
Exact Mass444.16
IUPAC Name2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene
SMILESc1ccc2c(-c3cc4cncc5cc(-c6cccc7ccccc67)c6ccc3n6c45)cccc2c1
InChIInChI=1S/C33H20N2/c1-3-11-25-21(7-1)9-5-13-27(25)29-17-23-19-34-20-24-18-30(32-16-15-31(29)35(32)33(23)24)28-14-6-10-22-8-2-4-12-26(22)28/h1-20H
InChIKeyIJLGYLALOYZUOI-UHFFFAOYSA-N
XLogP8.72
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.54
LogP ≤ 58.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene 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

Latrepirdine
CID 197033
Isocryptolepine
CID 380925
6,10-Diaza-1,5(1,4)-diquinolin-1-iuma-3(1,3),8(1,4)-dibenzenacyclodecaphane-11,51-diium
CID 656733
4-(3,4-Dihydro-1H-isoquinolin-2-yl)-quinoline
CID 18326767
2-Methyl-5-[9-(2-methylpyrido[4,3-b]indol-2-ium-5-yl)nonyl]pyrido[4,3-b]indol-2-ium diiodide
CID 122186429
2,8-dimethyl-5-(2-(pyridin-4-yl)ethyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
CID 621659
4-Piperidin-1-YL-2-pyridin-2-YL-quinoline
CID 2818423
1H-Indole, 3-((4-methyl-1-naphthalenyl)methyl)-1-pentyl-
CID 85879908
1-(1-Naphthylmethyl)quinolinium chloride
CID 103359
8-fluoro-5-(4-fluorophenyl)-2-(4-quinolin-4-ylbutyl)-3,4-dihydro-1H-pyrido[4,3-b]indole;hydrochloride
CID 13900391
2-Methyl-5-[8-(2-methylpyrido[4,3-b]indol-2-ium-5-yl)octyl]pyrido[4,3-b]indol-2-ium diiodide
CID 122186427
N-methyl-1-[[4-[4-[[4-(N-methylanilino)quinolin-1-ium-1-yl]methyl]phenyl]phenyl]methyl]-N-phenylquinolin-1-ium-4-amine dibromide
CID 11158640

Frequently Asked Questions

What is the IUPAC name of 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene?
The IUPAC name of 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene (CID 134962306) is 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene.
What is the SMILES notation for 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene?
The canonical SMILES for 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene is c1ccc2c(-c3cc4cncc5cc(-c6cccc7ccccc67)c6ccc3n6c45)cccc2c1.
What is the InChIKey of 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene?
The InChIKey is IJLGYLALOYZUOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H20N2/c1-3-11-25-21(7-1)9-5-13-27(25)29-17-23-19-34-20-24-18-30(32-16-15-31(29)35(32)33(23)24)28-14-6-10-22-8-2-4-12-26(22)28/h1-20H.
What are the key properties of 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene?
2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene has a molecular weight of 444.54 g/mol, XLogP of 8.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,10-dinaphthalen-1-yl-6,14-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1(13),2,4,6,8(15),9,11-heptaene is sourced from PubChem (CID 134962306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).