5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one

C9H15N3O2 — CID 103218289

IUPAC5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one
SMILESCC(C)OCCn1ncc(N)cc1=O
InChIInChI=1S/C9H15N3O2/c1-7(2)14-4-3-12-9(13)5-8(10)6-11-12/h5-7H,3-4,10H2,1-2H3
InChIKeyIDORJUYRTCXIPI-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.25
Rot. Bonds4

About 5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one

5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one (PubChem CID 103218289) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one.

Molecular Properties

Compound Name5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one
PubChem CID103218289
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one
SMILESCC(C)OCCn1ncc(N)cc1=O
InChIInChI=1S/C9H15N3O2/c1-7(2)14-4-3-12-9(13)5-8(10)6-11-12/h5-7H,3-4,10H2,1-2H3
InChIKeyIDORJUYRTCXIPI-UHFFFAOYSA-N
XLogP0.25
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Methyl-5-(morpholin-4-yl)pyridazin-3(2H)-one
CID 12473911
5-Amino-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103218426
5-(Ethylamino)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103219215
5-(Propan-2-ylamino)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103219592
5-(Propylamino)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 103220359
5-(Methylamino)-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyridazin-3-one
CID 113789723
5-[2-(2-Aminoethyl)morpholin-4-yl]-2-(2-ethoxyethyl)pyridazin-3-one
CID 56881771
5-Amino-2-(2-hydroxyethyl)pyridazin-3-one
CID 21449750
4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1H-pyridazin-6-one
CID 104961956
5-(3-Ethoxy-1-azetidinyl)-3(2H)-pyridazinone
CID 146273135
4-(3-methoxyazetidin-1-yl)-1H-pyridazin-6-one
CID 175973386
5-(dimethylamino)-2-(2-propoxyethyl)-3(2H)-pyridazinone
CID 28732206

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one?
The IUPAC name of 5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one (CID 103218289) is 5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one.
What is the SMILES notation for 5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one?
The canonical SMILES for 5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one is CC(C)OCCn1ncc(N)cc1=O.
What is the InChIKey of 5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one?
The InChIKey is IDORJUYRTCXIPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-7(2)14-4-3-12-9(13)5-8(10)6-11-12/h5-7H,3-4,10H2,1-2H3.
What are the key properties of 5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one?
5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one has a molecular weight of 197.24 g/mol, XLogP of 0.25, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(2-propan-2-yloxyethyl)pyridazin-3-one is sourced from PubChem (CID 103218289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).