9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine

C21H20N2 — CID 118881708

IUPAC9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine
SMILESCc1ccc(N2c3ccccc3C(C)(C)c3ccccc32)cn1
InChIInChI=1S/C21H20N2/c1-15-12-13-16(14-22-15)23-19-10-6-4-8-17(19)21(2,3)18-9-5-7-11-20(18)23/h4-14H,1-3H3
InChIKeyOBQSPFGIWHKXFF-UHFFFAOYSA-N
MW300.41 g/mol
LogP5.50
Rot. Bonds1

About 9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine

9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine (PubChem CID 118881708) has the molecular formula C21H20N2 and a molecular weight of 300.41 g/mol. Its IUPAC name is 9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine.

Molecular Properties

Compound Name9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine
PubChem CID118881708
Molecular FormulaC21H20N2
Molecular Weight300.41 g/mol
Exact Mass300.16
IUPAC Name9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine
SMILESCc1ccc(N2c3ccccc3C(C)(C)c3ccccc32)cn1
InChIInChI=1S/C21H20N2/c1-15-12-13-16(14-22-15)23-19-10-6-4-8-17(19)21(2,3)18-9-5-7-11-20(18)23/h4-14H,1-3H3
InChIKeyOBQSPFGIWHKXFF-UHFFFAOYSA-N
XLogP5.50
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.41
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine?
The IUPAC name of 9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine (CID 118881708) is 9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine.
What is the SMILES notation for 9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine?
The canonical SMILES for 9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine is Cc1ccc(N2c3ccccc3C(C)(C)c3ccccc32)cn1.
What is the InChIKey of 9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine?
The InChIKey is OBQSPFGIWHKXFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2/c1-15-12-13-16(14-22-15)23-19-10-6-4-8-17(19)21(2,3)18-9-5-7-11-20(18)23/h4-14H,1-3H3.
What are the key properties of 9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine?
9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine has a molecular weight of 300.41 g/mol, XLogP of 5.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine is sourced from PubChem (CID 118881708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).