6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one

C11H17N3O — CID 105460675

IUPAC6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one
SMILESCCn1nc(CCC2(N)CC2)ccc1=O
InChIInChI=1S/C11H17N3O/c1-2-14-10(15)4-3-9(13-14)5-6-11(12)7-8-11/h3-4H,2,5-8,12H2,1H3
InChIKeyUBTLZFGJNURXAJ-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.69
Rot. Bonds4

About 6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one

6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one (PubChem CID 105460675) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one.

Molecular Properties

Compound Name6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one
PubChem CID105460675
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one
SMILESCCn1nc(CCC2(N)CC2)ccc1=O
InChIInChI=1S/C11H17N3O/c1-2-14-10(15)4-3-9(13-14)5-6-11(12)7-8-11/h3-4H,2,5-8,12H2,1H3
InChIKeyUBTLZFGJNURXAJ-UHFFFAOYSA-N
XLogP0.69
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2S)-2-amino-3-methylbutyl]-6-cyclopropylpyridazin-3-one
CID 25802815
2-[(2R)-2-amino-3-methylbutyl]-6-cyclopropylpyridazin-3-one
CID 25802979
2,6-Dipentylpyridazin-3-one
CID 67710586
2-[[1-(2-Aminoethyl)cyclopropyl]methyl]-6-methylpyridazin-3-one
CID 65482149
6-(2-Aminopropan-2-yl)-2-ethylpyridazin-3-one
CID 82442179
6-(2-Aminopropan-2-yl)-2-propylpyridazin-3-one
CID 82442261
6-(2-Aminopropan-2-yl)-2-(2-methylpropyl)pyridazin-3-one
CID 82442340
6-(2-Aminopropan-2-yl)-2-butylpyridazin-3-one
CID 82442413
6-(1-Aminocyclopropyl)-2-methylpyridazin-3-one
CID 84764921
6-(1-Aminocyclopropyl)-2-ethylpyridazin-3-one
CID 84767901
6-(1-Aminocyclopropyl)-2-propan-2-ylpyridazin-3-one
CID 84772819
6-[2-(1-Aminocyclopropyl)ethyl]-2-methylpyridazin-3-one
CID 105447206

Frequently Asked Questions

What is the IUPAC name of 6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one?
The IUPAC name of 6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one (CID 105460675) is 6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one.
What is the SMILES notation for 6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one?
The canonical SMILES for 6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one is CCn1nc(CCC2(N)CC2)ccc1=O.
What is the InChIKey of 6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one?
The InChIKey is UBTLZFGJNURXAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-2-14-10(15)4-3-9(13-14)5-6-11(12)7-8-11/h3-4H,2,5-8,12H2,1H3.
What are the key properties of 6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one?
6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one has a molecular weight of 207.28 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(1-aminocyclopropyl)ethyl]-2-ethylpyridazin-3-one is sourced from PubChem (CID 105460675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).