1,3,6-trimethyl-1,2-dihydroacridine

C16H17N — CID 167262905

IUPAC1,3,6-trimethyl-1,2-dihydroacridine
SMILESCC1=Cc2nc3cc(C)ccc3cc2C(C)C1
InChIInChI=1S/C16H17N/c1-10-4-5-13-9-14-12(3)6-11(2)8-16(14)17-15(13)7-10/h4-5,7-9,12H,6H2,1-3H3
InChIKeyPBLPREYWXBGWQF-UHFFFAOYSA-N
MW223.32 g/mol
LogP4.45
Rot. Bonds

About 1,3,6-trimethyl-1,2-dihydroacridine

1,3,6-trimethyl-1,2-dihydroacridine (PubChem CID 167262905) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is 1,3,6-trimethyl-1,2-dihydroacridine.

Molecular Properties

Compound Name1,3,6-trimethyl-1,2-dihydroacridine
PubChem CID167262905
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC Name1,3,6-trimethyl-1,2-dihydroacridine
SMILESCC1=Cc2nc3cc(C)ccc3cc2C(C)C1
InChIInChI=1S/C16H17N/c1-10-4-5-13-9-14-12(3)6-11(2)8-16(14)17-15(13)7-10/h4-5,7-9,12H,6H2,1-3H3
InChIKeyPBLPREYWXBGWQF-UHFFFAOYSA-N
XLogP4.45
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,3,6-trimethyl-1,2-dihydroacridine?
The IUPAC name of 1,3,6-trimethyl-1,2-dihydroacridine (CID 167262905) is 1,3,6-trimethyl-1,2-dihydroacridine.
What is the SMILES notation for 1,3,6-trimethyl-1,2-dihydroacridine?
The canonical SMILES for 1,3,6-trimethyl-1,2-dihydroacridine is CC1=Cc2nc3cc(C)ccc3cc2C(C)C1.
What is the InChIKey of 1,3,6-trimethyl-1,2-dihydroacridine?
The InChIKey is PBLPREYWXBGWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N/c1-10-4-5-13-9-14-12(3)6-11(2)8-16(14)17-15(13)7-10/h4-5,7-9,12H,6H2,1-3H3.
What are the key properties of 1,3,6-trimethyl-1,2-dihydroacridine?
1,3,6-trimethyl-1,2-dihydroacridine has a molecular weight of 223.32 g/mol, XLogP of 4.45, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,6-trimethyl-1,2-dihydroacridine is sourced from PubChem (CID 167262905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).