5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine

C9H17N3O2 — CID 43554429

IUPAC5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine
SMILESCCOCCOc1c(N)c(C)nn1C
InChIInChI=1S/C9H17N3O2/c1-4-13-5-6-14-9-8(10)7(2)11-12(9)3/h4-6,10H2,1-3H3
InChIKeyLMWPXZICSPIFHG-UHFFFAOYSA-N
MW199.25 g/mol
LogP0.73
Rot. Bonds5

About 5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine

5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine (PubChem CID 43554429) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is 5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine.

Molecular Properties

Compound Name5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine
PubChem CID43554429
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine
SMILESCCOCCOc1c(N)c(C)nn1C
InChIInChI=1S/C9H17N3O2/c1-4-13-5-6-14-9-8(10)7(2)11-12(9)3/h4-6,10H2,1-3H3
InChIKeyLMWPXZICSPIFHG-UHFFFAOYSA-N
XLogP0.73
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 50.73
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

5-hexoxy-1,3-dimethylpyrazol-4-amine
CID 43554474
5-[3-(2-methoxyethoxy)propoxy]-1,3-dimethylpyrazol-4-amine
CID 103400910
5-[3-(dimethylamino)propoxy]-1,3-dimethylpyrazol-4-amine
CID 61102493
2-ethoxyethyl 4-amino-1,3-dimethylpyrazole-5-carboxylate
CID 66124995
5-(cyclopropylmethoxy)-1,3-dimethylpyrazol-4-amine
CID 43554459
3-ethyl-5-[2-(2-methoxyethoxy)ethoxy]-1-methylpyrazol-4-amine
CID 104560010
1-ethyl-5-[2-(2-methoxyethoxy)ethoxy]-3-methylpyrazol-4-amine
CID 104559959
5-(2-butoxyethoxy)-1-ethyl-3-methylpyrazol-4-amine
CID 66013671
5-[2-(2-methoxyethoxy)ethoxy]-1-methyl-3-propylpyrazol-4-amine
CID 104559958
1-ethyl-3-methyl-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyrazol-4-amine
CID 112587047
[4-(2-ethoxyethoxymethyl)-1,3-dimethylpyrazol-5-yl]hydrazine
CID 62246595
2-(4-chloro-1,3-dimethylpyrazol-5-yl)oxyethanamine
CID 84662341

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine?
The IUPAC name of 5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine (CID 43554429) is 5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine.
What is the SMILES notation for 5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine?
The canonical SMILES for 5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine is CCOCCOc1c(N)c(C)nn1C.
What is the InChIKey of 5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine?
The InChIKey is LMWPXZICSPIFHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-4-13-5-6-14-9-8(10)7(2)11-12(9)3/h4-6,10H2,1-3H3.
What are the key properties of 5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine?
5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine has a molecular weight of 199.25 g/mol, XLogP of 0.73, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxyethoxy)-1,3-dimethylpyrazol-4-amine is sourced from PubChem (CID 43554429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).