5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one

C14H23N5O2 — CID 114395890

IUPAC5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one
SMILESO=c1cc(N2CCOCC2)cnn1CCN1CCNCC1
InChIInChI=1S/C14H23N5O2/c20-14-11-13(18-7-9-21-10-8-18)12-16-19(14)6-5-17-3-1-15-2-4-17/h11-12,15H,1-10H2
InChIKeyYLWZOYFSPQHAPW-UHFFFAOYSA-N
MW293.37 g/mol
LogP-1.01
Rot. Bonds4

About 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one

5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one (PubChem CID 114395890) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one.

Molecular Properties

Compound Name5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one
PubChem CID114395890
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one
SMILESO=c1cc(N2CCOCC2)cnn1CCN1CCNCC1
InChIInChI=1S/C14H23N5O2/c20-14-11-13(18-7-9-21-10-8-18)12-16-19(14)6-5-17-3-1-15-2-4-17/h11-12,15H,1-10H2
InChIKeyYLWZOYFSPQHAPW-UHFFFAOYSA-N
XLogP-1.01
TPSA62.63 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 5-1.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one?
The IUPAC name of 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one (CID 114395890) is 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one.
What is the SMILES notation for 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one?
The canonical SMILES for 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one is O=c1cc(N2CCOCC2)cnn1CCN1CCNCC1.
What is the InChIKey of 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one?
The InChIKey is YLWZOYFSPQHAPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c20-14-11-13(18-7-9-21-10-8-18)12-16-19(14)6-5-17-3-1-15-2-4-17/h11-12,15H,1-10H2.
What are the key properties of 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one?
5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one has a molecular weight of 293.37 g/mol, XLogP of -1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one is sourced from PubChem (CID 114395890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).