2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one

C15H25N3O3 — CID 114397105

IUPAC2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
SMILESCOCCN(C)c1cnn(CCC2CCCC2O)c(=O)c1
InChIInChI=1S/C15H25N3O3/c1-17(8-9-21-2)13-10-15(20)18(16-11-13)7-6-12-4-3-5-14(12)19/h10-12,14,19H,3-9H2,1-2H3
InChIKeyFDXGPRJHJZYSJA-UHFFFAOYSA-N
MW295.38 g/mol
LogP0.88
Rot. Bonds7

About 2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one

2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one (PubChem CID 114397105) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is 2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one.

Molecular Properties

Compound Name2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
PubChem CID114397105
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC Name2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
SMILESCOCCN(C)c1cnn(CCC2CCCC2O)c(=O)c1
InChIInChI=1S/C15H25N3O3/c1-17(8-9-21-2)13-10-15(20)18(16-11-13)7-6-12-4-3-5-14(12)19/h10-12,14,19H,3-9H2,1-2H3
InChIKeyFDXGPRJHJZYSJA-UHFFFAOYSA-N
XLogP0.88
TPSA67.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[2-(2-Hydroxycyclopentyl)ethyl]-5-methylpyridazin-3-one
CID 106548982
2-(2-Cyclopentyl-2-hydroxyethyl)-5-methylpyridazin-3-one
CID 106548985
2-(4-Hydroxyhexyl)-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
CID 106802613
2-(6-Hydroxyhexyl)-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one
CID 107705276
2-(6-Hydroxyhexyl)-5-(3-methoxypyrrolidin-1-yl)pyridazin-3-one
CID 107705292
5-(Dimethylamino)-2-[2-(2-hydroxycyclopentyl)ethyl]pyridazin-3-one
CID 113579664
2-[2-(2-Hydroxycyclopentyl)ethyl]-5-pyrrolidin-1-ylpyridazin-3-one
CID 114397045
2-(2-Hydroxy-3-methylpentyl)-5-pyrrolidin-1-ylpyridazin-3-one
CID 114397047
2-(2-Cyclohexyl-2-hydroxyethyl)-5-pyrrolidin-1-ylpyridazin-3-one
CID 114397050
2-(2-Cyclopentyl-2-hydroxyethyl)-5-pyrrolidin-1-ylpyridazin-3-one
CID 114397054
5-(Dimethylamino)-2-(2-hydroxy-3-methylpentyl)pyridazin-3-one
CID 114397062
2-(2-Cyclohexyl-2-hydroxyethyl)-5-(dimethylamino)pyridazin-3-one
CID 114397065

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one?
The IUPAC name of 2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one (CID 114397105) is 2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one.
What is the SMILES notation for 2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one?
The canonical SMILES for 2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one is COCCN(C)c1cnn(CCC2CCCC2O)c(=O)c1.
What is the InChIKey of 2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one?
The InChIKey is FDXGPRJHJZYSJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-17(8-9-21-2)13-10-15(20)18(16-11-13)7-6-12-4-3-5-14(12)19/h10-12,14,19H,3-9H2,1-2H3.
What are the key properties of 2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one?
2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one has a molecular weight of 295.38 g/mol, XLogP of 0.88, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxycyclopentyl)ethyl]-5-[2-methoxyethyl(methyl)amino]pyridazin-3-one is sourced from PubChem (CID 114397105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).