3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine

C10H19N3O2 — CID 103131488

IUPAC3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine
SMILESCOCCOCCC(N)c1ccn(C)n1
InChIInChI=1S/C10H19N3O2/c1-13-5-3-10(12-13)9(11)4-6-15-8-7-14-2/h3,5,9H,4,6-8,11H2,1-2H3
InChIKeySQMUZJDGURBHRH-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.47
Rot. Bonds7

About 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine

3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine (PubChem CID 103131488) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine
PubChem CID103131488
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine
SMILESCOCCOCCC(N)c1ccn(C)n1
InChIInChI=1S/C10H19N3O2/c1-13-5-3-10(12-13)9(11)4-6-15-8-7-14-2/h3,5,9H,4,6-8,11H2,1-2H3
InChIKeySQMUZJDGURBHRH-UHFFFAOYSA-N
XLogP0.47
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 ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine?
The IUPAC name of 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine (CID 103131488) is 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine is COCCOCCC(N)c1ccn(C)n1.
What is the InChIKey of 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine?
The InChIKey is SQMUZJDGURBHRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-13-5-3-10(12-13)9(11)4-6-15-8-7-14-2/h3,5,9H,4,6-8,11H2,1-2H3.
What are the key properties of 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine?
3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine has a molecular weight of 213.28 g/mol, XLogP of 0.47, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-1-(1-methylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 103131488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).