5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one

C19H25N5O3 — CID 45209170

IUPAC5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one
SMILESCN(C)c1cnn(CC(=O)N2CCCC(OCc3ccccn3)C2)c(=O)c1
InChIInChI=1S/C19H25N5O3/c1-22(2)16-10-18(25)24(21-11-16)13-19(26)23-9-5-7-17(12-23)27-14-15-6-3-4-8-20-15/h3-4,6,8,10-11,17H,5,7,9,12-14H2,1-2H3
InChIKeyOZYKUXXPUGVKGC-UHFFFAOYSA-N
MW371.44 g/mol
LogP0.91
Rot. Bonds6

About 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one

5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one (PubChem CID 45209170) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one.

Molecular Properties

Compound Name5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one
PubChem CID45209170
Molecular FormulaC19H25N5O3
Molecular Weight371.44 g/mol
Exact Mass371.20
IUPAC Name5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one
SMILESCN(C)c1cnn(CC(=O)N2CCCC(OCc3ccccn3)C2)c(=O)c1
InChIInChI=1S/C19H25N5O3/c1-22(2)16-10-18(25)24(21-11-16)13-19(26)23-9-5-7-17(12-23)27-14-15-6-3-4-8-20-15/h3-4,6,8,10-11,17H,5,7,9,12-14H2,1-2H3
InChIKeyOZYKUXXPUGVKGC-UHFFFAOYSA-N
XLogP0.91
TPSA80.56 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one with MolForge

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Related Compounds

1-[2-[5-(Dimethylamino)-2-pyridinyl]morpholin-4-yl]-2-methoxyethanone
CID 110269056
1-Methyl-4-(2-pyridin-2-ylmorpholine-4-carbonyl)pyridin-2-one
CID 110271131
1-Methyl-4-[2-(5-methyl-2-pyridinyl)morpholine-4-carbonyl]pyridin-2-one
CID 118740200
2-Pyridylmethyl 4-methylpiperazine-1-carboxylate
CID 515594
N-methyl-2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethanamine
CID 56871589
2-{[4-(Pyridin-2-ylmethoxy)piperidin-1-yl]carbonyl}pyrazine
CID 91792217
1-Methyl-3-{2-oxo-2-[4-(pyridin-2-ylmethoxy)piperidin-1-YL]ethyl}imidazolidin-2-one
CID 121509142
1-ethyl-2-oxo-N-[(3S,4S)-4-(pyridin-2-ylmethoxy)oxan-3-yl]pyridine-4-carboxamide
CID 164637649
5-[(5-Fluoro-2-pyridinyl)methoxy]-2-[2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethyl]pyridazin-3-one
CID 58042877
5-(5-Fluoro-pyridin-2-ylmethoxy)-2-(tetrahydro-pyran-2-yl)-2H-pyridazin-3-one
CID 58092194
4-[(5-Fluoro-2-pyridinyl)methoxy]-1-(oxan-2-yl)pyridin-2-one
CID 68891939
(2-Fluorobenzyl)methyl{2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl}amine
CID 91786226

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one?
The IUPAC name of 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one (CID 45209170) is 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one.
What is the SMILES notation for 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one?
The canonical SMILES for 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one is CN(C)c1cnn(CC(=O)N2CCCC(OCc3ccccn3)C2)c(=O)c1.
What is the InChIKey of 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one?
The InChIKey is OZYKUXXPUGVKGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O3/c1-22(2)16-10-18(25)24(21-11-16)13-19(26)23-9-5-7-17(12-23)27-14-15-6-3-4-8-20-15/h3-4,6,8,10-11,17H,5,7,9,12-14H2,1-2H3.
What are the key properties of 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one?
5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one has a molecular weight of 371.44 g/mol, XLogP of 0.91, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-2-[2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethyl]pyridazin-3-one is sourced from PubChem (CID 45209170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).