1-ethyl-4-(methoxymethyl)pyrazol-5-amine

C7H13N3O — CID 117216754

IUPAC1-ethyl-4-(methoxymethyl)pyrazol-5-amine
SMILESCCn1ncc(COC)c1N
InChIInChI=1S/C7H13N3O/c1-3-10-7(8)6(4-9-10)5-11-2/h4H,3,5,8H2,1-2H3
InChIKeyDGJJOSHQTVJJRQ-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.63
Rot. Bonds3

About 1-ethyl-4-(methoxymethyl)pyrazol-5-amine

1-ethyl-4-(methoxymethyl)pyrazol-5-amine (PubChem CID 117216754) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 1-ethyl-4-(methoxymethyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-ethyl-4-(methoxymethyl)pyrazol-5-amine
PubChem CID117216754
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name1-ethyl-4-(methoxymethyl)pyrazol-5-amine
SMILESCCn1ncc(COC)c1N
InChIInChI=1S/C7H13N3O/c1-3-10-7(8)6(4-9-10)5-11-2/h4H,3,5,8H2,1-2H3
InChIKeyDGJJOSHQTVJJRQ-UHFFFAOYSA-N
XLogP0.63
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(methoxymethyl)-1-methylpyrazol-5-amine
CID 84648635
1-ethyl-4-(piperazin-1-ylmethyl)pyrazol-5-amine
CID 117216696
4-[(cyclobutylamino)methyl]-1-ethylpyrazol-5-amine
CID 117216682
1-(5-amino-1-ethylpyrazol-4-yl)ethanone
CID 119054334
(1-ethyl-5-fluoropyrazol-4-yl)methanamine
CID 115011510
4-[2-(methoxymethyl)phenyl]-1-methylpyrazol-5-amine
CID 117309638
1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine
CID 105471347
[1-ethyl-5-(2-methylpropyl)pyrazol-4-yl]methanamine
CID 105439736
[1-ethyl-5-(trifluoromethyl)pyrazol-4-yl]methanamine
CID 66440321
2-(5-bromo-1-ethylpyrazol-4-yl)acetamide
CID 166560098
4-(ethoxymethyl)-1-ethylpyrazole-5-carboxylic acid
CID 117216852
4-(methoxymethyl)-1-methylpyrazol-3-amine
CID 105428233

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(methoxymethyl)pyrazol-5-amine?
The IUPAC name of 1-ethyl-4-(methoxymethyl)pyrazol-5-amine (CID 117216754) is 1-ethyl-4-(methoxymethyl)pyrazol-5-amine.
What is the SMILES notation for 1-ethyl-4-(methoxymethyl)pyrazol-5-amine?
The canonical SMILES for 1-ethyl-4-(methoxymethyl)pyrazol-5-amine is CCn1ncc(COC)c1N.
What is the InChIKey of 1-ethyl-4-(methoxymethyl)pyrazol-5-amine?
The InChIKey is DGJJOSHQTVJJRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-3-10-7(8)6(4-9-10)5-11-2/h4H,3,5,8H2,1-2H3.
What are the key properties of 1-ethyl-4-(methoxymethyl)pyrazol-5-amine?
1-ethyl-4-(methoxymethyl)pyrazol-5-amine has a molecular weight of 155.20 g/mol, XLogP of 0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(methoxymethyl)pyrazol-5-amine is sourced from PubChem (CID 117216754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).