5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one

C18H27N5O4 — CID 97284720

IUPAC5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one
SMILESCN(C)c1cnn(CC(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)c(=O)c1
InChIInChI=1S/C18H27N5O4/c1-20(2)15-10-16(24)23(19-11-15)13-17(25)22-5-3-4-14(12-22)18(26)21-6-8-27-9-7-21/h10-11,14H,3-9,12-13H2,1-2H3/t14-/m1/s1
InChIKeyPWLBNRLXMFEFGG-CQSZACIVSA-N
MW377.45 g/mol
LogP-0.59
Rot. Bonds4

About 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one

5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one (PubChem CID 97284720) has the molecular formula C18H27N5O4 and a molecular weight of 377.45 g/mol. Its IUPAC name is 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one.

Molecular Properties

Compound Name5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one
PubChem CID97284720
Molecular FormulaC18H27N5O4
Molecular Weight377.45 g/mol
Exact Mass377.21
IUPAC Name5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one
SMILESCN(C)c1cnn(CC(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)c(=O)c1
InChIInChI=1S/C18H27N5O4/c1-20(2)15-10-16(24)23(19-11-15)13-17(25)22-5-3-4-14(12-22)18(26)21-6-8-27-9-7-21/h10-11,14H,3-9,12-13H2,1-2H3/t14-/m1/s1
InChIKeyPWLBNRLXMFEFGG-CQSZACIVSA-N
XLogP-0.59
TPSA87.98 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 5-0.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one with MolForge

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Related Compounds

2-[2-[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-oxoethyl]-5-(dimethylamino)pyridazin-3-one
CID 72838190
5-(dimethylamino)-2-[2-oxo-2-[4-(oxolan-2-ylmethyl)piperazin-1-yl]ethyl]pyridazin-3-one
CID 45195111
5-[2-aminoethyl(methyl)amino]-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one
CID 103223399
1-methyl-3-[2-[3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 55507898
5-(dimethylamino)-2-[2-[2-(2-methoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl]pyridazin-3-one
CID 45245591
5-(dimethylamino)-2-[2-oxo-2-[(2S)-2-[2-(2-oxopyrrolidin-1-yl)ethyl]piperidin-1-yl]ethyl]pyridazin-3-one
CID 97286609
[1-(5-methylpyrazine-2-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 42783455
[(3R)-1-(1-ethyl-3-propan-2-ylpyrazole-5-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 125161347
3-(3-methylphenyl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
CID 134000175
5-(dimethylamino)-2-[2-[(2R)-2-(3-fluorophenyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one
CID 97277231
1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-2-phenylsulfanylethanone
CID 75838690
1-[(3S)-3-(azepane-1-carbonyl)pyrrolidin-1-yl]-2-(3,5-dimethylpyrazol-1-yl)ethanone
CID 92633517

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one?
The IUPAC name of 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one (CID 97284720) is 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one.
What is the SMILES notation for 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one?
The canonical SMILES for 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one is CN(C)c1cnn(CC(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)c(=O)c1.
What is the InChIKey of 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one?
The InChIKey is PWLBNRLXMFEFGG-CQSZACIVSA-N. The full InChI is InChI=1S/C18H27N5O4/c1-20(2)15-10-16(24)23(19-11-15)13-17(25)22-5-3-4-14(12-22)18(26)21-6-8-27-9-7-21/h10-11,14H,3-9,12-13H2,1-2H3/t14-/m1/s1.
What are the key properties of 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one?
5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one has a molecular weight of 377.45 g/mol, XLogP of -0.59, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-2-[2-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]pyridazin-3-one is sourced from PubChem (CID 97284720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).