1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one

C15H16N4O5 — CID 137208165

IUPAC1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one
SMILESCCn1c(O)c(/N=N/c2ccc([N+](=O)[O-])cc2OC)c(C)cc1=O
InChIInChI=1S/C15H16N4O5/c1-4-18-13(20)7-9(2)14(15(18)21)17-16-11-6-5-10(19(22)23)8-12(11)24-3/h5-8,21H,4H2,1-3H3/b17-16+
InChIKeySAHVLUCEQYNZKX-WUKNDPDISA-N
MW332.32 g/mol
LogP3.21
Rot. Bonds5

About 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one

1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one (PubChem CID 137208165) has the molecular formula C15H16N4O5 and a molecular weight of 332.32 g/mol. Its IUPAC name is 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one.

Molecular Properties

Compound Name1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one
PubChem CID137208165
Molecular FormulaC15H16N4O5
Molecular Weight332.32 g/mol
Exact Mass332.11
IUPAC Name1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one
SMILESCCn1c(O)c(/N=N/c2ccc([N+](=O)[O-])cc2OC)c(C)cc1=O
InChIInChI=1S/C15H16N4O5/c1-4-18-13(20)7-9(2)14(15(18)21)17-16-11-6-5-10(19(22)23)8-12(11)24-3/h5-8,21H,4H2,1-3H3/b17-16+
InChIKeySAHVLUCEQYNZKX-WUKNDPDISA-N
XLogP3.21
TPSA119.32 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.32
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,3-diethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)iminomethyl]pyrimidine-2,4-dione
CID 4624154
5-(dihexylamino)-2-[(2-methoxy-4-nitrophenyl)diazenyl]phenol
CID 163433155
1-ethyl-6-hydroxy-3-[(2-hydroxy-5-nitrophenyl)diazenyl]-5-isocyano-4-methylpyridin-2-one
CID 135608384
sodium [(2-methoxy-4-nitrophenyl)diazenyl]cyanamide
CID 170844614
N-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylaniline
CID 86081155
2-[[4-(diethylamino)-2-methoxyphenyl]diazenyl]-5-nitrobenzene-1,3-dicarbonitrile
CID 20605739
1-butyl-2-hydroxy-4-methyl-5-[(2-methyl-4-nitrophenyl)diazenyl]-6-oxopyridine-3-carbonitrile
CID 135835667
ethane;2-methoxy-4-nitrophenol
CID 91188946
dichloromethane;2-methoxy-4-nitrophenol
CID 141183892
5-[(2,4-dinitrophenyl)diazenyl]-2-hydroxy-1-(2-methoxyethyl)-4-methyl-6-oxopyridine-3-carbonitrile
CID 135835241
sodium;hydride;2-methoxy-5-nitrophenol
CID 173002361
(E)-3-hydroxy-2-[(2-methoxy-4-nitrophenyl)diazenyl]-N-methylbut-2-enamide
CID 135624062

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one?
The IUPAC name of 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one (CID 137208165) is 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one.
What is the SMILES notation for 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one?
The canonical SMILES for 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one is CCn1c(O)c(/N=N/c2ccc([N+](=O)[O-])cc2OC)c(C)cc1=O.
What is the InChIKey of 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one?
The InChIKey is SAHVLUCEQYNZKX-WUKNDPDISA-N. The full InChI is InChI=1S/C15H16N4O5/c1-4-18-13(20)7-9(2)14(15(18)21)17-16-11-6-5-10(19(22)23)8-12(11)24-3/h5-8,21H,4H2,1-3H3/b17-16+.
What are the key properties of 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one?
1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one has a molecular weight of 332.32 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-hydroxy-5-[(2-methoxy-4-nitrophenyl)diazenyl]-4-methylpyridin-2-one is sourced from PubChem (CID 137208165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).