1-(2,3-diethoxypropyl)pyrazol-3-amine

C10H19N3O2 — CID 67521475

IUPAC1-(2,3-diethoxypropyl)pyrazol-3-amine
SMILESCCOCC(Cn1ccc(N)n1)OCC
InChIInChI=1S/C10H19N3O2/c1-3-14-8-9(15-4-2)7-13-6-5-10(11)12-13/h5-6,9H,3-4,7-8H2,1-2H3,(H2,11,12)
InChIKeyQVRRAIXUFYXFRZ-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.91
Rot. Bonds7

About 1-(2,3-diethoxypropyl)pyrazol-3-amine

1-(2,3-diethoxypropyl)pyrazol-3-amine (PubChem CID 67521475) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 1-(2,3-diethoxypropyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(2,3-diethoxypropyl)pyrazol-3-amine
PubChem CID67521475
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name1-(2,3-diethoxypropyl)pyrazol-3-amine
SMILESCCOCC(Cn1ccc(N)n1)OCC
InChIInChI=1S/C10H19N3O2/c1-3-14-8-9(15-4-2)7-13-6-5-10(11)12-13/h5-6,9H,3-4,7-8H2,1-2H3,(H2,11,12)
InChIKeyQVRRAIXUFYXFRZ-UHFFFAOYSA-N
XLogP0.91
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-diethoxypropyl)pyrazol-3-amine?
The IUPAC name of 1-(2,3-diethoxypropyl)pyrazol-3-amine (CID 67521475) is 1-(2,3-diethoxypropyl)pyrazol-3-amine.
What is the SMILES notation for 1-(2,3-diethoxypropyl)pyrazol-3-amine?
The canonical SMILES for 1-(2,3-diethoxypropyl)pyrazol-3-amine is CCOCC(Cn1ccc(N)n1)OCC.
What is the InChIKey of 1-(2,3-diethoxypropyl)pyrazol-3-amine?
The InChIKey is QVRRAIXUFYXFRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-3-14-8-9(15-4-2)7-13-6-5-10(11)12-13/h5-6,9H,3-4,7-8H2,1-2H3,(H2,11,12).
What are the key properties of 1-(2,3-diethoxypropyl)pyrazol-3-amine?
1-(2,3-diethoxypropyl)pyrazol-3-amine has a molecular weight of 213.28 g/mol, XLogP of 0.91, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-diethoxypropyl)pyrazol-3-amine is sourced from PubChem (CID 67521475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).