[3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine

C10H17N3O2 — CID 103486302

IUPAC[3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine
SMILESCCOCC(C)Oc1nnccc1CN
InChIInChI=1S/C10H17N3O2/c1-3-14-7-8(2)15-10-9(6-11)4-5-12-13-10/h4-5,8H,3,6-7,11H2,1-2H3
InChIKeyFHQFKNZGJIOZTH-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.74
Rot. Bonds6

About [3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine

[3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine (PubChem CID 103486302) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is [3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine
PubChem CID103486302
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name[3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine
SMILESCCOCC(C)Oc1nnccc1CN
InChIInChI=1S/C10H17N3O2/c1-3-14-7-8(2)15-10-9(6-11)4-5-12-13-10/h4-5,8H,3,6-7,11H2,1-2H3
InChIKeyFHQFKNZGJIOZTH-UHFFFAOYSA-N
XLogP0.74
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine?
The IUPAC name of [3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine (CID 103486302) is [3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine.
What is the SMILES notation for [3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine?
The canonical SMILES for [3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine is CCOCC(C)Oc1nnccc1CN.
What is the InChIKey of [3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine?
The InChIKey is FHQFKNZGJIOZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-3-14-7-8(2)15-10-9(6-11)4-5-12-13-10/h4-5,8H,3,6-7,11H2,1-2H3.
What are the key properties of [3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine?
[3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine has a molecular weight of 211.26 g/mol, XLogP of 0.74, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine is sourced from PubChem (CID 103486302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).