5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one

C10H17N3O2 — CID 104920971

IUPAC5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one
SMILESCCN(C)c1cnn(C[C@@H](C)O)c(=O)c1
InChIInChI=1S/C10H17N3O2/c1-4-12(3)9-5-10(15)13(11-6-9)7-8(2)14/h5-6,8,14H,4,7H2,1-3H3/t8-/m1/s1
InChIKeyMKQXMMVEAZEAEZ-MRVPVSSYSA-N
MW211.26 g/mol
LogP0.08
Rot. Bonds4

About 5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one

5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one (PubChem CID 104920971) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one.

Molecular Properties

Compound Name5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one
PubChem CID104920971
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one
SMILESCCN(C)c1cnn(C[C@@H](C)O)c(=O)c1
InChIInChI=1S/C10H17N3O2/c1-4-12(3)9-5-10(15)13(11-6-9)7-8(2)14/h5-6,8,14H,4,7H2,1-3H3/t8-/m1/s1
InChIKeyMKQXMMVEAZEAEZ-MRVPVSSYSA-N
XLogP0.08
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-Piperidin-1-yl-2-(3,3,3-trifluoro-2-hydroxypropyl)pyridazin-3-one
CID 45200136
2-[(2S)-2,3-dihydroxypropyl]-5-(1-piperidinyl)-3(2H)-pyridazinone
CID 56889724
5-(Dimethylamino)-2-(3-fluoro-2-hydroxypropyl)-2,3-dihydropyridazin-3-one
CID 165601120
5-Amino-2-(2-hydroxyethyl)pyridazin-3-one
CID 21449750
5-(dimethylamino)-2-(2-propoxyethyl)-3(2H)-pyridazinone
CID 28732206
2-(2,3-dihydroxypropyl)-5-(4-methyl-1-piperazinyl)-3(2H)-pyridazinone
CID 56897302
2-(2,3-Dihydroxypropyl)-5-piperidin-1-ylpyridazin-3-one
CID 76424722
5-Amino-2-(2-hydroxypropyl)pyridazin-3-one
CID 103218365
5-Amino-2-(2-methoxypropyl)pyridazin-3-one
CID 103218443
2-(2,3-Dihydroxypropyl)-5-(methylamino)pyridazin-3-one
CID 103218588
2-(2-Hydroxypropyl)-5-(methylamino)pyridazin-3-one
CID 103218681
5-(Ethylamino)-2-(2-hydroxyethyl)pyridazin-3-one
CID 103218848

Frequently Asked Questions

What is the IUPAC name of 5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one?
The IUPAC name of 5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one (CID 104920971) is 5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one.
What is the SMILES notation for 5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one?
The canonical SMILES for 5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one is CCN(C)c1cnn(C[C@@H](C)O)c(=O)c1.
What is the InChIKey of 5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one?
The InChIKey is MKQXMMVEAZEAEZ-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-4-12(3)9-5-10(15)13(11-6-9)7-8(2)14/h5-6,8,14H,4,7H2,1-3H3/t8-/m1/s1.
What are the key properties of 5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one?
5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one has a molecular weight of 211.26 g/mol, XLogP of 0.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[ethyl(methyl)amino]-2-[(2R)-2-hydroxypropyl]pyridazin-3-one is sourced from PubChem (CID 104920971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).