5-amino-2-(2-methoxypropyl)pyridazin-3-one

C8H13N3O2 — CID 103218443

IUPAC5-amino-2-(2-methoxypropyl)pyridazin-3-one
SMILESCOC(C)Cn1ncc(N)cc1=O
InChIInChI=1S/C8H13N3O2/c1-6(13-2)5-11-8(12)3-7(9)4-10-11/h3-4,6H,5,9H2,1-2H3
InChIKeyRVNKRLXZZHTYQI-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.14
Rot. Bonds3

About 5-amino-2-(2-methoxypropyl)pyridazin-3-one

5-amino-2-(2-methoxypropyl)pyridazin-3-one (PubChem CID 103218443) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 5-amino-2-(2-methoxypropyl)pyridazin-3-one.

Molecular Properties

Compound Name5-amino-2-(2-methoxypropyl)pyridazin-3-one
PubChem CID103218443
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name5-amino-2-(2-methoxypropyl)pyridazin-3-one
SMILESCOC(C)Cn1ncc(N)cc1=O
InChIInChI=1S/C8H13N3O2/c1-6(13-2)5-11-8(12)3-7(9)4-10-11/h3-4,6H,5,9H2,1-2H3
InChIKeyRVNKRLXZZHTYQI-UHFFFAOYSA-N
XLogP-0.14
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-2-(2-methylpropyl)pyridazin-3-one
CID 103218168
5-amino-2-[(3,5-dimethylphenyl)methyl]pyridazin-3-one
CID 103218225
tert-butyl N-[2-[[1-(2-methoxypropyl)-6-oxopyridazin-4-yl]amino]ethyl]carbamate
CID 103220950
5-amino-2-[(6-methoxypyridazin-3-yl)methyl]pyridazin-3-one
CID 114268942
5-amino-2-[(2-methoxy-5-methylphenyl)methyl]pyridazin-3-one
CID 103218397
5-amino-2-[3-(dimethylamino)propyl]pyridazin-3-one
CID 103218206
2-bromo-5-(2-methoxypropyl)thieno[2,3-d]pyridazin-4-one
CID 176653420
5-amino-2-[(5-methyl-3-pyridinyl)methyl]pyridazin-3-one
CID 103218315
5-amino-2-[(2-methyl-1,2,4-triazol-3-yl)methyl]pyridazin-3-one
CID 103218195
5-amino-2-[(2-ethyl-1,2,4-triazol-3-yl)methyl]pyridazin-3-one
CID 103218301
2-(4-amino-6-oxopyridazin-1-yl)-N-(2-methoxyphenyl)acetamide
CID 103218386
2-(4-amino-6-oxopyridazin-1-yl)butanenitrile
CID 103218401

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(2-methoxypropyl)pyridazin-3-one?
The IUPAC name of 5-amino-2-(2-methoxypropyl)pyridazin-3-one (CID 103218443) is 5-amino-2-(2-methoxypropyl)pyridazin-3-one.
What is the SMILES notation for 5-amino-2-(2-methoxypropyl)pyridazin-3-one?
The canonical SMILES for 5-amino-2-(2-methoxypropyl)pyridazin-3-one is COC(C)Cn1ncc(N)cc1=O.
What is the InChIKey of 5-amino-2-(2-methoxypropyl)pyridazin-3-one?
The InChIKey is RVNKRLXZZHTYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-6(13-2)5-11-8(12)3-7(9)4-10-11/h3-4,6H,5,9H2,1-2H3.
What are the key properties of 5-amino-2-(2-methoxypropyl)pyridazin-3-one?
5-amino-2-(2-methoxypropyl)pyridazin-3-one has a molecular weight of 183.21 g/mol, XLogP of -0.14, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(2-methoxypropyl)pyridazin-3-one is sourced from PubChem (CID 103218443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).