4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one

C15H19N3O2 — CID 16756196

IUPAC4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one
SMILESCCNc1c(C(C)O)c(-c2ccccc2)nn(C)c1=O
InChIInChI=1S/C15H19N3O2/c1-4-16-14-12(10(2)19)13(17-18(3)15(14)20)11-8-6-5-7-9-11/h5-10,16,19H,4H2,1-3H3
InChIKeyAFJOOXNAFMFLCK-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.93
Rot. Bonds4

About 4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one

4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one (PubChem CID 16756196) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one.

Molecular Properties

Compound Name4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one
PubChem CID16756196
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one
SMILESCCNc1c(C(C)O)c(-c2ccccc2)nn(C)c1=O
InChIInChI=1S/C15H19N3O2/c1-4-16-14-12(10(2)19)13(17-18(3)15(14)20)11-8-6-5-7-9-11/h5-10,16,19H,4H2,1-3H3
InChIKeyAFJOOXNAFMFLCK-UHFFFAOYSA-N
XLogP1.93
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-butyl-5-(1-hydroxyethyl)-4-(methylamino)-6-phenylpyridazin-3-one
CID 16756096
1-(5-chloro-1-methyl-3-phenylpyrazol-4-yl)propan-1-ol
CID 3756816
5-hydroxy-2-methyl-4,6-diphenylpyridazin-3-one
CID 54677994
4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethylamino]-2-methyl-5-(2-methylpropanoyl)-6-phenylpyridazin-3-one
CID 10074286
3-hydroxy-2-[(2-methyl-3-oxo-5,6-diphenylpyridazine-4-carbonyl)amino]butanoic acid
CID 108790658
2-methyl-3-oxo-5,6-diphenyl-N-propylpyridazine-4-carboxamide
CID 108790559
5-acetyl-2-methyl-4-methylsulfinyl-6-phenylpyridazin-3-one
CID 10379463
2-methyl-3-oxo-5,6-diphenyl-N-(3-propan-2-yloxypropyl)pyridazine-4-carboxamide
CID 108790644
5-hydroxy-2-methyl-6-phenylpyridazin-3-one
CID 54705880
ethyl 2-[(2-methyl-3-oxo-5,6-diphenylpyridazine-4-carbonyl)amino]acetate
CID 108803402
1-[(5-chloro-1-methyl-3-phenylpyrazol-4-yl)methylamino]propan-2-ol
CID 111421573
5-benzamido-1-methyl-3-phenylpyrazole-4-carboxylic acid
CID 59608695

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one?
The IUPAC name of 4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one (CID 16756196) is 4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one.
What is the SMILES notation for 4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one?
The canonical SMILES for 4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one is CCNc1c(C(C)O)c(-c2ccccc2)nn(C)c1=O.
What is the InChIKey of 4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one?
The InChIKey is AFJOOXNAFMFLCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-4-16-14-12(10(2)19)13(17-18(3)15(14)20)11-8-6-5-7-9-11/h5-10,16,19H,4H2,1-3H3.
What are the key properties of 4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one?
4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one has a molecular weight of 273.34 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-5-(1-hydroxyethyl)-2-methyl-6-phenylpyridazin-3-one is sourced from PubChem (CID 16756196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).