4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one

C17H20N2O4 — CID 163183627

IUPAC4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one
SMILESCn1c(=O)c(C(=O)CCN2CCOCC2)c(O)c2ccccc21
InChIInChI=1S/C17H20N2O4/c1-18-13-5-3-2-4-12(13)16(21)15(17(18)22)14(20)6-7-19-8-10-23-11-9-19/h2-5,21H,6-11H2,1H3
InChIKeyWWWUHHZWGCTYFY-UHFFFAOYSA-N
MW316.36 g/mol
LogP1.15
Rot. Bonds4

About 4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one

4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one (PubChem CID 163183627) has the molecular formula C17H20N2O4 and a molecular weight of 316.36 g/mol. Its IUPAC name is 4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one
PubChem CID163183627
Molecular FormulaC17H20N2O4
Molecular Weight316.36 g/mol
Exact Mass316.14
IUPAC Name4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one
SMILESCn1c(=O)c(C(=O)CCN2CCOCC2)c(O)c2ccccc21
InChIInChI=1S/C17H20N2O4/c1-18-13-5-3-2-4-12(13)16(21)15(17(18)22)14(20)6-7-19-8-10-23-11-9-19/h2-5,21H,6-11H2,1H3
InChIKeyWWWUHHZWGCTYFY-UHFFFAOYSA-N
XLogP1.15
TPSA71.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-acetyl-4-hydroxy-1-methylquinolin-2-one
CID 54697138
1-(4-methylnaphthalen-1-yl)-3-morpholin-4-ylpropan-1-one
CID 82050956
3-[(3S)-3-amino-3-(2-hydroxyphenyl)propanoyl]-4-hydroxy-1-methylquinolin-2-one
CID 54747504
4-hydroxy-3-[(Z)-N-hydroxy-C-methylcarbonimidoyl]-1-methylquinolin-2-one
CID 136914834
4-hydroxy-3-(N-hydroxy-C-methylcarbonimidoyl)-1-methylquinolin-2-one
CID 135419029
3-pyrrolidin-1-yl-1-[10-(3-pyrrolidin-1-ylpropanoyl)anthracen-9-yl]propan-1-one
CID 139708502
4-hydroxy-1-methyl-2-oxo-N-phenylquinoline-3-carboxamide
CID 54676449
3-[(3S)-3-amino-3-(4-chlorophenyl)propanoyl]-4-hydroxy-1-methylquinolin-2-one
CID 54747502
3-ethanehydrazonoyl-4-hydroxy-1-methylquinolin-2-one
CID 135454306
4-acetyl-3-hydroxy-1-methylquinolin-2-one
CID 134987022
ethane;1-methyl-3-(2-morpholin-4-ylethyl)benzimidazol-2-one
CID 143665895
4-hydroxy-3-[3-(2-hydroxyphenyl)-3-(N-phenylanilino)propanoyl]-1-methylquinolin-2-one
CID 54697106

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one?
The IUPAC name of 4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one (CID 163183627) is 4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one.
What is the SMILES notation for 4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one?
The canonical SMILES for 4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one is Cn1c(=O)c(C(=O)CCN2CCOCC2)c(O)c2ccccc21.
What is the InChIKey of 4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one?
The InChIKey is WWWUHHZWGCTYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4/c1-18-13-5-3-2-4-12(13)16(21)15(17(18)22)14(20)6-7-19-8-10-23-11-9-19/h2-5,21H,6-11H2,1H3.
What are the key properties of 4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one?
4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one has a molecular weight of 316.36 g/mol, XLogP of 1.15, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-methyl-3-(3-morpholin-4-ylpropanoyl)quinolin-2-one is sourced from PubChem (CID 163183627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).