1-methoxy-4-propan-2-yloxyphthalazine;propane

C15H22N2O2 — CID 142833574

IUPAC1-methoxy-4-propan-2-yloxyphthalazine;propane
SMILESCCC.COc1nnc(OC(C)C)c2ccccc12
InChIInChI=1S/C12H14N2O2.C3H8/c1-8(2)16-12-10-7-5-4-6-9(10)11(15-3)13-14-12;1-3-2/h4-8H,1-3H3;3H2,1-2H3
InChIKeyJXJJQOYOFDETRA-UHFFFAOYSA-N
MW262.35 g/mol
LogP3.84
Rot. Bonds3

About 1-methoxy-4-propan-2-yloxyphthalazine;propane

1-methoxy-4-propan-2-yloxyphthalazine;propane (PubChem CID 142833574) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 1-methoxy-4-propan-2-yloxyphthalazine;propane.

Molecular Properties

Compound Name1-methoxy-4-propan-2-yloxyphthalazine;propane
PubChem CID142833574
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name1-methoxy-4-propan-2-yloxyphthalazine;propane
SMILESCCC.COc1nnc(OC(C)C)c2ccccc12
InChIInChI=1S/C12H14N2O2.C3H8/c1-8(2)16-12-10-7-5-4-6-9(10)11(15-3)13-14-12;1-3-2/h4-8H,1-3H3;3H2,1-2H3
InChIKeyJXJJQOYOFDETRA-UHFFFAOYSA-N
XLogP3.84
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-propan-2-yloxyphthalazine;propane?
The IUPAC name of 1-methoxy-4-propan-2-yloxyphthalazine;propane (CID 142833574) is 1-methoxy-4-propan-2-yloxyphthalazine;propane.
What is the SMILES notation for 1-methoxy-4-propan-2-yloxyphthalazine;propane?
The canonical SMILES for 1-methoxy-4-propan-2-yloxyphthalazine;propane is CCC.COc1nnc(OC(C)C)c2ccccc12.
What is the InChIKey of 1-methoxy-4-propan-2-yloxyphthalazine;propane?
The InChIKey is JXJJQOYOFDETRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2.C3H8/c1-8(2)16-12-10-7-5-4-6-9(10)11(15-3)13-14-12;1-3-2/h4-8H,1-3H3;3H2,1-2H3.
What are the key properties of 1-methoxy-4-propan-2-yloxyphthalazine;propane?
1-methoxy-4-propan-2-yloxyphthalazine;propane has a molecular weight of 262.35 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-propan-2-yloxyphthalazine;propane is sourced from PubChem (CID 142833574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).