5-(2-aminoethoxy)-2-ethylpyridazin-3-one

C8H13N3O2 — CID 103222762

IUPAC5-(2-aminoethoxy)-2-ethylpyridazin-3-one
SMILESCCn1ncc(OCCN)cc1=O
InChIInChI=1S/C8H13N3O2/c1-2-11-8(12)5-7(6-10-11)13-4-3-9/h5-6H,2-4,9H2,1H3
InChIKeyMQWWJUMWGZEDDU-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.40
Rot. Bonds4

About 5-(2-aminoethoxy)-2-ethylpyridazin-3-one

5-(2-aminoethoxy)-2-ethylpyridazin-3-one (PubChem CID 103222762) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 5-(2-aminoethoxy)-2-ethylpyridazin-3-one.

Molecular Properties

Compound Name5-(2-aminoethoxy)-2-ethylpyridazin-3-one
PubChem CID103222762
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name5-(2-aminoethoxy)-2-ethylpyridazin-3-one
SMILESCCn1ncc(OCCN)cc1=O
InChIInChI=1S/C8H13N3O2/c1-2-11-8(12)5-7(6-10-11)13-4-3-9/h5-6H,2-4,9H2,1H3
InChIKeyMQWWJUMWGZEDDU-UHFFFAOYSA-N
XLogP-0.40
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-Aminoethoxy)-2-[3-(2,2,2-trifluoroethoxy)propyl]pyridazin-3-one
CID 103222856
5-(2-Aminoethoxy)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103222873
5-(2-Aminopropoxy)-2-[3-(2,2,2-trifluoroethoxy)propyl]pyridazin-3-one
CID 103223073
5-(2-Aminopropoxy)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103223090
5-(3-Aminopropoxy)-2-[3-(2,2,2-trifluoroethoxy)propyl]pyridazin-3-one
CID 103223282
5-(3-Aminopropoxy)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103223299
2-[6-Oxo-1-(2,2,2-trifluoroethyl)pyridazin-4-yl]oxyacetamide
CID 162567664
2-(2-Ethoxyethyl)-5-hydroxypyridazin-3-one
CID 57059473
2-(2-methoxy-ethyl)-5-methoxy-2H-pyridazin-3-one
CID 66865610
2-Ethyl-5-methoxy-2,3-dihydropyridazin-3-one
CID 66865616
5-Ethoxy-2-methylpyridazin-3-one
CID 10511059
methyl N-[2-(1-tert-butyl-6-oxopyridazin-4-yl)oxyethyl]carbamate
CID 56683966

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethoxy)-2-ethylpyridazin-3-one?
The IUPAC name of 5-(2-aminoethoxy)-2-ethylpyridazin-3-one (CID 103222762) is 5-(2-aminoethoxy)-2-ethylpyridazin-3-one.
What is the SMILES notation for 5-(2-aminoethoxy)-2-ethylpyridazin-3-one?
The canonical SMILES for 5-(2-aminoethoxy)-2-ethylpyridazin-3-one is CCn1ncc(OCCN)cc1=O.
What is the InChIKey of 5-(2-aminoethoxy)-2-ethylpyridazin-3-one?
The InChIKey is MQWWJUMWGZEDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-2-11-8(12)5-7(6-10-11)13-4-3-9/h5-6H,2-4,9H2,1H3.
What are the key properties of 5-(2-aminoethoxy)-2-ethylpyridazin-3-one?
5-(2-aminoethoxy)-2-ethylpyridazin-3-one has a molecular weight of 183.21 g/mol, XLogP of -0.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethoxy)-2-ethylpyridazin-3-one is sourced from PubChem (CID 103222762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).