2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one

C14H22N4O2 — CID 103218116

IUPAC2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one
SMILESCCN1CCOC(Cn2nc3c(cc2=O)NCCC3)C1
InChIInChI=1S/C14H22N4O2/c1-2-17-6-7-20-11(9-17)10-18-14(19)8-13-12(16-18)4-3-5-15-13/h8,11,15H,2-7,9-10H2,1H3
InChIKeyIPLDPJMOHAYZGL-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.32
Rot. Bonds3

About 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one

2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one (PubChem CID 103218116) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one.

Molecular Properties

Compound Name2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one
PubChem CID103218116
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one
SMILESCCN1CCOC(Cn2nc3c(cc2=O)NCCC3)C1
InChIInChI=1S/C14H22N4O2/c1-2-17-6-7-20-11(9-17)10-18-14(19)8-13-12(16-18)4-3-5-15-13/h8,11,15H,2-7,9-10H2,1H3
InChIKeyIPLDPJMOHAYZGL-UHFFFAOYSA-N
XLogP0.32
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one with MolForge

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Related Compounds

2-[2-(4-methylpiperazin-1-yl)ethyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one
CID 103218160
1-[(4-ethylmorpholin-2-yl)methyl]pyrrole-2,5-dione
CID 114400408
2-(3-ethylsulfonylpropyl)-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one
CID 103218005
1-[(4-ethylmorpholin-2-yl)methyl]pyrimidin-2-one
CID 116618394
2-[(4-ethylmorpholin-2-yl)methyl]pyrazole-3-carboxylic acid
CID 79172074
5-(3-aminopropoxy)-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one
CID 103223272
4,5-dichloro-2-[(4-ethylmorpholin-2-yl)methyl]pyridazin-3-one
CID 114386480
N-(oxan-4-yl)-2-(3-oxo-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-2-yl)acetamide
CID 103218132
3-[(4-ethylmorpholin-2-yl)methyl]benzotriazole-5-carboxylic acid
CID 114400330
4-ethyl-2-[(3-ethyl-3-methyl-1,4-diazepan-1-yl)methyl]morpholine
CID 114401357
N-(2-methylbutan-2-yl)-2-(3-oxo-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-2-yl)acetamide
CID 103218030
2-[(2,5-difluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one
CID 103217946

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one?
The IUPAC name of 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one (CID 103218116) is 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one.
What is the SMILES notation for 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one?
The canonical SMILES for 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one is CCN1CCOC(Cn2nc3c(cc2=O)NCCC3)C1.
What is the InChIKey of 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one?
The InChIKey is IPLDPJMOHAYZGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-2-17-6-7-20-11(9-17)10-18-14(19)8-13-12(16-18)4-3-5-15-13/h8,11,15H,2-7,9-10H2,1H3.
What are the key properties of 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one?
2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one has a molecular weight of 278.36 g/mol, XLogP of 0.32, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[3,2-c]pyridazin-3-one is sourced from PubChem (CID 103218116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).