2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one

C10H17N3O3 — CID 105061525

IUPAC2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one
SMILESCCOC(CN)Cn1nc(OC)ccc1=O
InChIInChI=1S/C10H17N3O3/c1-3-16-8(6-11)7-13-10(14)5-4-9(12-13)15-2/h4-5,8H,3,6-7,11H2,1-2H3
InChIKeyPAKVCJJRJTVWMR-UHFFFAOYSA-N
MW227.26 g/mol
LogP-0.38
Rot. Bonds6

About 2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one

2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one (PubChem CID 105061525) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is 2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one.

Molecular Properties

Compound Name2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one
PubChem CID105061525
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one
SMILESCCOC(CN)Cn1nc(OC)ccc1=O
InChIInChI=1S/C10H17N3O3/c1-3-16-8(6-11)7-13-10(14)5-4-9(12-13)15-2/h4-5,8H,3,6-7,11H2,1-2H3
InChIKeyPAKVCJJRJTVWMR-UHFFFAOYSA-N
XLogP-0.38
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3(2H)-Pyridazinone, 6-[2-(diethylamino)ethoxy]-2-methyl-
CID 12015112
2-(4-Amino-3-ethoxybutyl)pyridazin-3-one
CID 63070112
2-(3-Amino-2-ethoxypropyl)pyridazin-3-one
CID 63072355
2-(3-Amino-2-ethoxypropyl)-6-methylpyridazin-3-one
CID 63072539
2-[2-(2-Aminoethoxy)ethyl]-6-methoxypyridazin-3-one
CID 103482444
2-(4-Aminobutyl)-6-methoxypyridazin-3-one
CID 105061500
2-(3-Aminopropyl)-6-methoxypyridazin-3-one
CID 105061504
2-(3-Amino-2-methylpropyl)-6-methoxypyridazin-3-one
CID 105061509
2-(4-Amino-3-ethoxybutyl)-6-methoxypyridazin-3-one
CID 105061521
6-Methoxy-2-[3-(propan-2-ylamino)propyl]pyridazin-3-one
CID 105061625
6-Methoxy-2-[3-(methylamino)propyl]pyridazin-3-one
CID 105061675
6-Methoxy-2-[3-(propylamino)propyl]pyridazin-3-one
CID 105061699

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one?
The IUPAC name of 2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one (CID 105061525) is 2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one.
What is the SMILES notation for 2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one?
The canonical SMILES for 2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one is CCOC(CN)Cn1nc(OC)ccc1=O.
What is the InChIKey of 2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one?
The InChIKey is PAKVCJJRJTVWMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c1-3-16-8(6-11)7-13-10(14)5-4-9(12-13)15-2/h4-5,8H,3,6-7,11H2,1-2H3.
What are the key properties of 2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one?
2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one has a molecular weight of 227.26 g/mol, XLogP of -0.38, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-2-ethoxypropyl)-6-methoxypyridazin-3-one is sourced from PubChem (CID 105061525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).