5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one

C11H19N3O — CID 103218939

IUPAC5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one
SMILESCCNc1cnn(CCC(C)C)c(=O)c1
InChIInChI=1S/C11H19N3O/c1-4-12-10-7-11(15)14(13-8-10)6-5-9(2)3/h7-9,12H,4-6H2,1-3H3
InChIKeyVIPYXOOEVYNFMU-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.72
Rot. Bonds5

About 5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one

5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one (PubChem CID 103218939) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one
PubChem CID103218939
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one
SMILESCCNc1cnn(CCC(C)C)c(=O)c1
InChIInChI=1S/C11H19N3O/c1-4-12-10-7-11(15)14(13-8-10)6-5-9(2)3/h7-9,12H,4-6H2,1-3H3
InChIKeyVIPYXOOEVYNFMU-UHFFFAOYSA-N
XLogP1.72
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N~2~-methyl-N~1~-{[1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-3-pyrrolidinyl]methyl}glycinamide
CID 70761816
5-pyrrolidin-1-yl-2-(pyrrolidin-3-ylmethyl)pyridazin-3(2H)-one
CID 72876309
2-[2-(Aminomethyl)-3,3,3-trifluoropropyl]-5-[ethyl(methyl)amino]pyridazin-3-one
CID 103366657
2-[2-(Aminomethyl)-3,3,3-trifluoropropyl]-5-(diethylamino)pyridazin-3-one
CID 103366658
2-[2-(Aminomethyl)-3,3,3-trifluoropropyl]-5-[methyl(propyl)amino]pyridazin-3-one
CID 103366659
2-[(3,3-Difluorocyclopentyl)methyl]-5-(ethylamino)pyridazin-3-one
CID 114226081
4-(4-methylpentylamino)-1H-pyridazin-6-one
CID 114392023
4-Methanimidoyl-5-(methylamino)-2-prop-2-enylpyridazin-3-one
CID 156187890
N-(1-methyl-6-oxopyridazin-4-yl)propanamide
CID 170387108
3-methyl-N-(1-methyl-6-oxopyridazin-4-yl)butanamide
CID 176873099
5-(Ethylamino)-2-methylpyridazin-3-one
CID 10487061
2-Methyl-5-(methylamino)pyridazin-3(2H)-one
CID 10510928

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one?
The IUPAC name of 5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one (CID 103218939) is 5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one.
What is the SMILES notation for 5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one?
The canonical SMILES for 5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one is CCNc1cnn(CCC(C)C)c(=O)c1.
What is the InChIKey of 5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one?
The InChIKey is VIPYXOOEVYNFMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-12-10-7-11(15)14(13-8-10)6-5-9(2)3/h7-9,12H,4-6H2,1-3H3.
What are the key properties of 5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one?
5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one has a molecular weight of 209.29 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-2-(3-methylbutyl)pyridazin-3-one is sourced from PubChem (CID 103218939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).