2-(2-methoxypropyl)-5-methylpyrazol-3-amine

C8H15N3O — CID 130929651

IUPAC2-(2-methoxypropyl)-5-methylpyrazol-3-amine
SMILESCOC(C)Cn1nc(C)cc1N
InChIInChI=1S/C8H15N3O/c1-6-4-8(9)11(10-6)5-7(2)12-3/h4,7H,5,9H2,1-3H3
InChIKeyLIEDFHYWQBACQW-UHFFFAOYSA-N
MW169.23 g/mol
LogP0.81
Rot. Bonds3

About 2-(2-methoxypropyl)-5-methylpyrazol-3-amine

2-(2-methoxypropyl)-5-methylpyrazol-3-amine (PubChem CID 130929651) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 2-(2-methoxypropyl)-5-methylpyrazol-3-amine.

Molecular Properties

Compound Name2-(2-methoxypropyl)-5-methylpyrazol-3-amine
PubChem CID130929651
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name2-(2-methoxypropyl)-5-methylpyrazol-3-amine
SMILESCOC(C)Cn1nc(C)cc1N
InChIInChI=1S/C8H15N3O/c1-6-4-8(9)11(10-6)5-7(2)12-3/h4,7H,5,9H2,1-3H3
InChIKeyLIEDFHYWQBACQW-UHFFFAOYSA-N
XLogP0.81
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxypropyl)-5-methylpyrazol-3-amine?
The IUPAC name of 2-(2-methoxypropyl)-5-methylpyrazol-3-amine (CID 130929651) is 2-(2-methoxypropyl)-5-methylpyrazol-3-amine.
What is the SMILES notation for 2-(2-methoxypropyl)-5-methylpyrazol-3-amine?
The canonical SMILES for 2-(2-methoxypropyl)-5-methylpyrazol-3-amine is COC(C)Cn1nc(C)cc1N.
What is the InChIKey of 2-(2-methoxypropyl)-5-methylpyrazol-3-amine?
The InChIKey is LIEDFHYWQBACQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-6-4-8(9)11(10-6)5-7(2)12-3/h4,7H,5,9H2,1-3H3.
What are the key properties of 2-(2-methoxypropyl)-5-methylpyrazol-3-amine?
2-(2-methoxypropyl)-5-methylpyrazol-3-amine has a molecular weight of 169.23 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxypropyl)-5-methylpyrazol-3-amine is sourced from PubChem (CID 130929651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).