2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol

C19H21NO — CID 70255183

IUPAC2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol
SMILESCN1CC(C)(C)CC2=C1C=CC1(O)C2=Cc2ccccc21
InChIInChI=1S/C19H21NO/c1-18(2)11-14-16-10-13-6-4-5-7-15(13)19(16,21)9-8-17(14)20(3)12-18/h4-10,21H,11-12H2,1-3H3
InChIKeyANQDVGSQQWPURY-UHFFFAOYSA-N
MW279.38 g/mol
LogP3.46
Rot. Bonds

About 2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol

2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol (PubChem CID 70255183) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is 2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol.

Molecular Properties

Compound Name2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol
PubChem CID70255183
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC Name2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol
SMILESCN1CC(C)(C)CC2=C1C=CC1(O)C2=Cc2ccccc21
InChIInChI=1S/C19H21NO/c1-18(2)11-14-16-10-13-6-4-5-7-15(13)19(16,21)9-8-17(14)20(3)12-18/h4-10,21H,11-12H2,1-3H3
InChIKeyANQDVGSQQWPURY-UHFFFAOYSA-N
XLogP3.46
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol?
The IUPAC name of 2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol (CID 70255183) is 2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol.
What is the SMILES notation for 2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol?
The canonical SMILES for 2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol is CN1CC(C)(C)CC2=C1C=CC1(O)C2=Cc2ccccc21.
What is the InChIKey of 2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol?
The InChIKey is ANQDVGSQQWPURY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c1-18(2)11-14-16-10-13-6-4-5-7-15(13)19(16,21)9-8-17(14)20(3)12-18/h4-10,21H,11-12H2,1-3H3.
What are the key properties of 2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol?
2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol has a molecular weight of 279.38 g/mol, XLogP of 3.46, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4-trimethyl-1,3-dihydroindeno[2,1-f]quinolin-6a-ol is sourced from PubChem (CID 70255183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).