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'}

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Related Compounds

1-(1-methylpyrazol-3-yl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 103147975
(2R)-2-amino-2-(1-methylpyrazol-3-yl)ethanol;dihydrochloride
CID 155905387
N-[2-(2-methoxyethoxy)ethyl]-1-methylpyrazol-3-amine
CID 79778277
1-methoxy-3-(1-methylpyrazol-3-yl)propan-2-amine
CID 82876471
N-ethyl-1-(1-methylpyrazol-3-yl)-3-propoxypropan-1-amine
CID 103134564
2-(1-methylimidazol-2-yl)-1-(1-methylpyrazol-3-yl)ethanamine
CID 79760474
3-(2-methoxyethoxy)-1-(1-propylimidazol-2-yl)propan-1-amine
CID 102927817
1-(1-methylpyrazol-3-yl)ethanamine;hydrochloride
CID 130453998
2-(6-methoxy-3-pyridinyl)-1-(1-methylpyrazol-3-yl)ethanamine
CID 103131183
2-(3-methoxyphenyl)-1-(1-methylpyrazol-3-yl)ethanamine
CID 65200559
1-(2-methoxyethoxy)-3-[(1-methylpyrazol-3-yl)amino]propan-2-ol
CID 106990156
2-(4-chlorophenyl)-1-(1-methylpyrazol-3-yl)ethanamine
CID 65200453

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).