5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one

C7H11N3O3 — CID 103218304

IUPAC5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one
SMILESNc1cnn(CC(O)CO)c(=O)c1
InChIInChI=1S/C7H11N3O3/c8-5-1-7(13)10(9-2-5)3-6(12)4-11/h1-2,6,11-12H,3-4,8H2
InChIKeyHVLZWPKIAUKYBK-UHFFFAOYSA-N
MW185.18 g/mol
LogP-1.82
Rot. Bonds3

About 5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one

5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one (PubChem CID 103218304) has the molecular formula C7H11N3O3 and a molecular weight of 185.18 g/mol. Its IUPAC name is 5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one.

Molecular Properties

Compound Name5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one
PubChem CID103218304
Molecular FormulaC7H11N3O3
Molecular Weight185.18 g/mol
Exact Mass185.08
IUPAC Name5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one
SMILESNc1cnn(CC(O)CO)c(=O)c1
InChIInChI=1S/C7H11N3O3/c8-5-1-7(13)10(9-2-5)3-6(12)4-11/h1-2,6,11-12H,3-4,8H2
InChIKeyHVLZWPKIAUKYBK-UHFFFAOYSA-N
XLogP-1.82
TPSA101.37 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 5-1.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

5-Amino-2-(2-hydroxyethyl)pyridazin-3-one
CID 21449750
5-Amino-2-(3-hydroxypropyl)pyridazin-3-one
CID 103218258
5-Amino-2-(3-hydroxy-2-methylpropyl)pyridazin-3-one
CID 103218313
5-Amino-2-(2-hydroxypropyl)pyridazin-3-one
CID 103218365
5-Amino-2-[2-(2-hydroxyethoxy)ethyl]pyridazin-3-one
CID 103218398
2-(2-Hydroxyethyl)-5-(methylamino)pyridazin-3-one
CID 103218461
2-(3-Hydroxypropyl)-5-(methylamino)pyridazin-3-one
CID 103218540
2-(2,3-Dihydroxypropyl)-5-(methylamino)pyridazin-3-one
CID 103218588
2-(2-Hydroxypropyl)-5-(methylamino)pyridazin-3-one
CID 103218681
5-(Ethylamino)-2-(3-hydroxypropyl)pyridazin-3-one
CID 103218955
2-(2,3-Dihydroxypropyl)-5-(ethylamino)pyridazin-3-one
CID 103219027
5-(Ethylamino)-2-(2-hydroxypropyl)pyridazin-3-one
CID 103219123

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one?
The IUPAC name of 5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one (CID 103218304) is 5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one.
What is the SMILES notation for 5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one?
The canonical SMILES for 5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one is Nc1cnn(CC(O)CO)c(=O)c1.
What is the InChIKey of 5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one?
The InChIKey is HVLZWPKIAUKYBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O3/c8-5-1-7(13)10(9-2-5)3-6(12)4-11/h1-2,6,11-12H,3-4,8H2.
What are the key properties of 5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one?
5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one has a molecular weight of 185.18 g/mol, XLogP of -1.82, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(2,3-dihydroxypropyl)pyridazin-3-one is sourced from PubChem (CID 103218304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).