9-(1-acridin-9-ylethyl)acridine

C28H20N2 — CID 118649577

IUPAC9-(1-acridin-9-ylethyl)acridine
SMILESCC(c1c2ccccc2nc2ccccc12)c1c2ccccc2nc2ccccc12
InChIInChI=1S/C28H20N2/c1-18(27-19-10-2-6-14-23(19)29-24-15-7-3-11-20(24)27)28-21-12-4-8-16-25(21)30-26-17-9-5-13-22(26)28/h2-18H,1H3
InChIKeyNGFHUOHJHDWBKP-UHFFFAOYSA-N
MW384.48 g/mol
LogP7.24
Rot. Bonds2

About 9-(1-acridin-9-ylethyl)acridine

9-(1-acridin-9-ylethyl)acridine (PubChem CID 118649577) has the molecular formula C28H20N2 and a molecular weight of 384.48 g/mol. Its IUPAC name is 9-(1-acridin-9-ylethyl)acridine.

Molecular Properties

Compound Name9-(1-acridin-9-ylethyl)acridine
PubChem CID118649577
Molecular FormulaC28H20N2
Molecular Weight384.48 g/mol
Exact Mass384.16
IUPAC Name9-(1-acridin-9-ylethyl)acridine
SMILESCC(c1c2ccccc2nc2ccccc12)c1c2ccccc2nc2ccccc12
InChIInChI=1S/C28H20N2/c1-18(27-19-10-2-6-14-23(19)29-24-15-7-3-11-20(24)27)28-21-12-4-8-16-25(21)30-26-17-9-5-13-22(26)28/h2-18H,1H3
InChIKeyNGFHUOHJHDWBKP-UHFFFAOYSA-N
XLogP7.24
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 57.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

9-(dimethoxymethyl)acridine
CID 14219888
9-benzhydrylacridine
CID 71328841
6-(1-phenylethyl)phenanthridine
CID 154722213
2-ethyl-4-propan-2-ylquinoline
CID 144871804
acridin-9-amine;λ2-plumbane
CID 173496858
3-ethyl-4-propan-2-ylquinoline
CID 134512006
6-propan-2-yloxyphenanthridine
CID 71037197
(1S)-1-(4-amino-2-methylquinolin-3-yl)ethanol
CID 920146
9-(tribromomethyl)acridine
CID 18471467
phenazine;silver
CID 175026023
2-bromo-4-propan-2-ylquinoline
CID 146082408
hydron;phenazine
CID 175446889

Frequently Asked Questions

What is the IUPAC name of 9-(1-acridin-9-ylethyl)acridine?
The IUPAC name of 9-(1-acridin-9-ylethyl)acridine (CID 118649577) is 9-(1-acridin-9-ylethyl)acridine.
What is the SMILES notation for 9-(1-acridin-9-ylethyl)acridine?
The canonical SMILES for 9-(1-acridin-9-ylethyl)acridine is CC(c1c2ccccc2nc2ccccc12)c1c2ccccc2nc2ccccc12.
What is the InChIKey of 9-(1-acridin-9-ylethyl)acridine?
The InChIKey is NGFHUOHJHDWBKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20N2/c1-18(27-19-10-2-6-14-23(19)29-24-15-7-3-11-20(24)27)28-21-12-4-8-16-25(21)30-26-17-9-5-13-22(26)28/h2-18H,1H3.
What are the key properties of 9-(1-acridin-9-ylethyl)acridine?
9-(1-acridin-9-ylethyl)acridine has a molecular weight of 384.48 g/mol, XLogP of 7.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(1-acridin-9-ylethyl)acridine is sourced from PubChem (CID 118649577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).