5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one

C13H17NO2 — CID 20719518

IUPAC5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one
SMILESCc1cc(C)c2c(c1O)C(C)(C)CC(=O)N2
InChIInChI=1S/C13H17NO2/c1-7-5-8(2)12(16)10-11(7)14-9(15)6-13(10,3)4/h5,16H,6H2,1-4H3,(H,14,15)
InChIKeyPURANCCJRDJIAI-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.63
Rot. Bonds

About 5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one

5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one (PubChem CID 20719518) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is 5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one.

Molecular Properties

Compound Name5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one
PubChem CID20719518
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one
SMILESCc1cc(C)c2c(c1O)C(C)(C)CC(=O)N2
InChIInChI=1S/C13H17NO2/c1-7-5-8(2)12(16)10-11(7)14-9(15)6-13(10,3)4/h5,16H,6H2,1-4H3,(H,14,15)
InChIKeyPURANCCJRDJIAI-UHFFFAOYSA-N
XLogP2.63
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one?
The IUPAC name of 5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one (CID 20719518) is 5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one.
What is the SMILES notation for 5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one?
The canonical SMILES for 5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one is Cc1cc(C)c2c(c1O)C(C)(C)CC(=O)N2.
What is the InChIKey of 5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one?
The InChIKey is PURANCCJRDJIAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-7-5-8(2)12(16)10-11(7)14-9(15)6-13(10,3)4/h5,16H,6H2,1-4H3,(H,14,15).
What are the key properties of 5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one?
5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one has a molecular weight of 219.28 g/mol, XLogP of 2.63, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-4,4,6,8-tetramethyl-1,3-dihydroquinolin-2-one is sourced from PubChem (CID 20719518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).