6-amino-2-propylpyridazin-3-one

C7H11N3O — CID 82467415

IUPAC6-amino-2-propylpyridazin-3-one
SMILESCCCn1nc(N)ccc1=O
InChIInChI=1S/C7H11N3O/c1-2-5-10-7(11)4-3-6(8)9-10/h3-4H,2,5H2,1H3,(H2,8,9)
InChIKeyGEPUUISBTCIQCA-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.24
Rot. Bonds2

About 6-amino-2-propylpyridazin-3-one

6-amino-2-propylpyridazin-3-one (PubChem CID 82467415) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 6-amino-2-propylpyridazin-3-one.

Molecular Properties

Compound Name6-amino-2-propylpyridazin-3-one
PubChem CID82467415
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name6-amino-2-propylpyridazin-3-one
SMILESCCCn1nc(N)ccc1=O
InChIInChI=1S/C7H11N3O/c1-2-5-10-7(11)4-3-6(8)9-10/h3-4H,2,5H2,1H3,(H2,8,9)
InChIKeyGEPUUISBTCIQCA-UHFFFAOYSA-N
XLogP0.24
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-2-propylpyridazin-3-one?
The IUPAC name of 6-amino-2-propylpyridazin-3-one (CID 82467415) is 6-amino-2-propylpyridazin-3-one.
What is the SMILES notation for 6-amino-2-propylpyridazin-3-one?
The canonical SMILES for 6-amino-2-propylpyridazin-3-one is CCCn1nc(N)ccc1=O.
What is the InChIKey of 6-amino-2-propylpyridazin-3-one?
The InChIKey is GEPUUISBTCIQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-2-5-10-7(11)4-3-6(8)9-10/h3-4H,2,5H2,1H3,(H2,8,9).
What are the key properties of 6-amino-2-propylpyridazin-3-one?
6-amino-2-propylpyridazin-3-one has a molecular weight of 153.19 g/mol, XLogP of 0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-propylpyridazin-3-one is sourced from PubChem (CID 82467415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).