2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one

C16H25N3O3 — CID 10063825

IUPAC2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one
SMILESCCOc1nn(C2CCCCC2)c(=O)cc1N1CCOCC1
InChIInChI=1S/C16H25N3O3/c1-2-22-16-14(18-8-10-21-11-9-18)12-15(20)19(17-16)13-6-4-3-5-7-13/h12-13H,2-11H2,1H3
InChIKeyVJZTZUQROKLDKW-UHFFFAOYSA-N
MW307.39 g/mol
LogP1.98
Rot. Bonds4

About 2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one

2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one (PubChem CID 10063825) has the molecular formula C16H25N3O3 and a molecular weight of 307.39 g/mol. Its IUPAC name is 2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one.

Molecular Properties

Compound Name2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one
PubChem CID10063825
Molecular FormulaC16H25N3O3
Molecular Weight307.39 g/mol
Exact Mass307.19
IUPAC Name2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one
SMILESCCOc1nn(C2CCCCC2)c(=O)cc1N1CCOCC1
InChIInChI=1S/C16H25N3O3/c1-2-22-16-14(18-8-10-21-11-9-18)12-15(20)19(17-16)13-6-4-3-5-7-13/h12-13H,2-11H2,1H3
InChIKeyVJZTZUQROKLDKW-UHFFFAOYSA-N
XLogP1.98
TPSA56.59 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-Methoxy-2-methyl-5-morpholin-4-ylpyridazin-3-one
CID 9991237
5-Morpholin-4-yl-2-pentyl-6-propoxypyridazin-3-one
CID 9995485
2-Methyl-5-morpholin-4-yl-6-propoxypyridazin-3-one
CID 10015131
6-Ethoxy-2-methyl-5-piperidin-1-ylpyridazin-3-one
CID 10037168
6-Butoxy-2-ethyl-5-morpholin-4-ylpyridazin-3-one
CID 10039368
5-Morpholin-4-yl-6-propoxy-2-propylpyridazin-3-one
CID 10039369
6-Butoxy-2-methyl-5-piperidin-1-ylpyridazin-3-one
CID 10061409
6-Butoxy-2-methyl-5-morpholin-4-ylpyridazin-3-one
CID 10061509
2-Butyl-5-morpholin-4-yl-6-propoxypyridazin-3-one
CID 10085879
2-Hexyl-5-morpholin-4-yl-6-propoxypyridazin-3-one
CID 10087572
6-Hexoxy-2-methyl-5-morpholin-4-ylpyridazin-3-one
CID 10108558
2-Ethyl-5-morpholin-4-yl-6-pentoxypyridazin-3-one
CID 10108559

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one?
The IUPAC name of 2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one (CID 10063825) is 2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one.
What is the SMILES notation for 2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one?
The canonical SMILES for 2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one is CCOc1nn(C2CCCCC2)c(=O)cc1N1CCOCC1.
What is the InChIKey of 2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one?
The InChIKey is VJZTZUQROKLDKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3/c1-2-22-16-14(18-8-10-21-11-9-18)12-15(20)19(17-16)13-6-4-3-5-7-13/h12-13H,2-11H2,1H3.
What are the key properties of 2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one?
2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one has a molecular weight of 307.39 g/mol, XLogP of 1.98, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-6-ethoxy-5-morpholin-4-ylpyridazin-3-one is sourced from PubChem (CID 10063825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).