7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one

C19H19NO2 — CID 50975368

IUPAC7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one
SMILESC/C(=C\c1ccccc1)C1CC(=O)Nc2cc(O)c(C)cc21
InChIInChI=1S/C19H19NO2/c1-12(8-14-6-4-3-5-7-14)15-10-19(22)20-17-11-18(21)13(2)9-16(15)17/h3-9,11,15,21H,10H2,1-2H3,(H,20,22)/b12-8+
InChIKeyXTDHGNVDHQDFSV-XYOKQWHBSA-N
MW293.37 g/mol
LogP4.23
Rot. Bonds2

About 7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one

7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 50975368) has the molecular formula C19H19NO2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one
PubChem CID50975368
Molecular FormulaC19H19NO2
Molecular Weight293.37 g/mol
Exact Mass293.14
IUPAC Name7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one
SMILESC/C(=C\c1ccccc1)C1CC(=O)Nc2cc(O)c(C)cc21
InChIInChI=1S/C19H19NO2/c1-12(8-14-6-4-3-5-7-14)15-10-19(22)20-17-11-18(21)13(2)9-16(15)17/h3-9,11,15,21H,10H2,1-2H3,(H,20,22)/b12-8+
InChIKeyXTDHGNVDHQDFSV-XYOKQWHBSA-N
XLogP4.23
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one (CID 50975368) is 7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one is C/C(=C\c1ccccc1)C1CC(=O)Nc2cc(O)c(C)cc21.
What is the InChIKey of 7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is XTDHGNVDHQDFSV-XYOKQWHBSA-N. The full InChI is InChI=1S/C19H19NO2/c1-12(8-14-6-4-3-5-7-14)15-10-19(22)20-17-11-18(21)13(2)9-16(15)17/h3-9,11,15,21H,10H2,1-2H3,(H,20,22)/b12-8+.
What are the key properties of 7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one?
7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 293.37 g/mol, XLogP of 4.23, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-6-methyl-4-[(E)-1-phenylprop-1-en-2-yl]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 50975368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).