5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one

C10H17N3O2 — CID 103219042

IUPAC5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one
SMILESCCNc1cnn(CC(C)CO)c(=O)c1
InChIInChI=1S/C10H17N3O2/c1-3-11-9-4-10(15)13(12-5-9)6-8(2)7-14/h4-5,8,11,14H,3,6-7H2,1-2H3
InChIKeyRKSOLNIZGYNIKD-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.30
Rot. Bonds5

About 5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one

5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one (PubChem CID 103219042) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one.

Molecular Properties

Compound Name5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one
PubChem CID103219042
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one
SMILESCCNc1cnn(CC(C)CO)c(=O)c1
InChIInChI=1S/C10H17N3O2/c1-3-11-9-4-10(15)13(12-5-9)6-8(2)7-14/h4-5,8,11,14H,3,6-7H2,1-2H3
InChIKeyRKSOLNIZGYNIKD-UHFFFAOYSA-N
XLogP0.30
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-Methylpropylamino)-2-[3-(2,2,2-trifluoroethoxy)propyl]pyridazin-3-one
CID 103221686
4-Bromo-5-(3-hydroxypropylamino)-2-propylpyridazin-3-one
CID 114432726
4-Chloro-5-(3-hydroxypropylamino)-2-propylpyridazin-3-one
CID 114432730
5-Amino-2-(4-hydroxybutyl)pyridazin-3-one
CID 10012594
2-(4-Hydroxybutyl)-5-(methylamino)pyridazin-3-one
CID 10352676
5-(2-Hydroxyethylamino)-2-methylpyridazin-3-one
CID 85866137
5-Amino-2-(3-methoxypropyl)pyridazin-3-one
CID 103218207
5-Amino-2-(3-hydroxypropyl)pyridazin-3-one
CID 103218258
5-Amino-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one
CID 103218313
5-Amino-2-(3-hydroxy-3-methylbutyl)pyridazin-3-one
CID 103218372
5-(Methylamino)-2-(2-methylpropyl)pyridazin-3-one
CID 103218450
2-(2-Hydroxyethyl)-5-(methylamino)pyridazin-3-one
CID 103218461

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one?
The IUPAC name of 5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one (CID 103219042) is 5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one.
What is the SMILES notation for 5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one?
The canonical SMILES for 5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one is CCNc1cnn(CC(C)CO)c(=O)c1.
What is the InChIKey of 5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one?
The InChIKey is RKSOLNIZGYNIKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-3-11-9-4-10(15)13(12-5-9)6-8(2)7-14/h4-5,8,11,14H,3,6-7H2,1-2H3.
What are the key properties of 5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one?
5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one has a molecular weight of 211.26 g/mol, XLogP of 0.30, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one is sourced from PubChem (CID 103219042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).