2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one

C8H13N3O2 — CID 103218681

IUPAC2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one
SMILESCNc1cnn(CC(C)O)c(=O)c1
InChIInChI=1S/C8H13N3O2/c1-6(12)5-11-8(13)3-7(9-2)4-10-11/h3-4,6,9,12H,5H2,1-2H3
InChIKeyPZEOYOPFQHCTPA-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.33
Rot. Bonds3

About 2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one

2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one (PubChem CID 103218681) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one.

Molecular Properties

Compound Name2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one
PubChem CID103218681
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one
SMILESCNc1cnn(CC(C)O)c(=O)c1
InChIInChI=1S/C8H13N3O2/c1-6(12)5-11-8(13)3-7(9-2)4-10-11/h3-4,6,9,12H,5H2,1-2H3
InChIKeyPZEOYOPFQHCTPA-UHFFFAOYSA-N
XLogP-0.33
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(3,3,3-trifluoro-2-hydroxypropyl)amino]-1H-pyridazin-6-one
CID 105649468
4-[(3,3-difluoro-2-hydroxypropyl)amino]-1H-pyridazin-6-one
CID 105649469
5-(Dimethylamino)-2-(3-fluoro-2-hydroxypropyl)-2,3-dihydropyridazin-3-one
CID 165601120
5-Amino-2-(2-hydroxyethyl)pyridazin-3-one
CID 21449750
2-(4-Hydroxybutyl)-5-(methylamino)pyridazin-3-one
CID 10352676
2-[2-Hydroxy-3-(methylamino)propyl]pyridazin-3-one
CID 62848729
2-[3-(Ethylamino)-2-hydroxypropyl]pyridazin-3-one
CID 62848900
2-[2-Hydroxy-3-(propan-2-ylamino)propyl]pyridazin-3-one
CID 62848901
2-[2-Hydroxy-3-(propylamino)propyl]pyridazin-3-one
CID 62848902
5-(2-Hydroxyethylamino)-2-methylpyridazin-3-one
CID 85866137
4-bromo-5-[[(2S)-2-hydroxypropyl]amino]-2-methylpyridazin-3-one
CID 96536751
4-(2-methoxypropylamino)-1H-pyridazin-6-one
CID 102702189

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one?
The IUPAC name of 2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one (CID 103218681) is 2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one.
What is the SMILES notation for 2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one?
The canonical SMILES for 2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one is CNc1cnn(CC(C)O)c(=O)c1.
What is the InChIKey of 2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one?
The InChIKey is PZEOYOPFQHCTPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-6(12)5-11-8(13)3-7(9-2)4-10-11/h3-4,6,9,12H,5H2,1-2H3.
What are the key properties of 2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one?
2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one has a molecular weight of 183.21 g/mol, XLogP of -0.33, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxypropyl)-5-(methylamino)pyridazin-3-one is sourced from PubChem (CID 103218681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).