2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one

C15H23N3O3 — CID 114397076

IUPAC2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one
SMILESO=c1cc(N2CCOCC2)cnn1CCC1CCCC1O
InChIInChI=1S/C15H23N3O3/c19-14-3-1-2-12(14)4-5-18-15(20)10-13(11-16-18)17-6-8-21-9-7-17/h10-12,14,19H,1-9H2
InChIKeyJTFWECDWSNPVDX-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.63
Rot. Bonds4

About 2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one

2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one (PubChem CID 114397076) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one.

Molecular Properties

Compound Name2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one
PubChem CID114397076
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one
SMILESO=c1cc(N2CCOCC2)cnn1CCC1CCCC1O
InChIInChI=1S/C15H23N3O3/c19-14-3-1-2-12(14)4-5-18-15(20)10-13(11-16-18)17-6-8-21-9-7-17/h10-12,14,19H,1-9H2
InChIKeyJTFWECDWSNPVDX-UHFFFAOYSA-N
XLogP0.63
TPSA67.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one?
The IUPAC name of 2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one (CID 114397076) is 2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one.
What is the SMILES notation for 2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one?
The canonical SMILES for 2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one is O=c1cc(N2CCOCC2)cnn1CCC1CCCC1O.
What is the InChIKey of 2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one?
The InChIKey is JTFWECDWSNPVDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c19-14-3-1-2-12(14)4-5-18-15(20)10-13(11-16-18)17-6-8-21-9-7-17/h10-12,14,19H,1-9H2.
What are the key properties of 2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one?
2-[2-(2-hydroxycyclopentyl)ethyl]-5-morpholin-4-ylpyridazin-3-one has a molecular weight of 293.37 g/mol, XLogP of 0.63, 4 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-morpholin-4-ylpyridazin-3-one is sourced from PubChem (CID 114397076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).