1-(2-methoxyethyl)pyrazol-3-amine

C6H11N3O — CID 45116728

IUPAC1-(2-methoxyethyl)pyrazol-3-amine
SMILESCOCCn1ccc(N)n1
InChIInChI=1S/C6H11N3O/c1-10-5-4-9-3-2-6(7)8-9/h2-3H,4-5H2,1H3,(H2,7,8)
InChIKeyCIZWSGSWDKEWQD-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.11
Rot. Bonds3

About 1-(2-methoxyethyl)pyrazol-3-amine

1-(2-methoxyethyl)pyrazol-3-amine (PubChem CID 45116728) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 1-(2-methoxyethyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)pyrazol-3-amine
PubChem CID45116728
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name1-(2-methoxyethyl)pyrazol-3-amine
SMILESCOCCn1ccc(N)n1
InChIInChI=1S/C6H11N3O/c1-10-5-4-9-3-2-6(7)8-9/h2-3H,4-5H2,1H3,(H2,7,8)
InChIKeyCIZWSGSWDKEWQD-UHFFFAOYSA-N
XLogP0.11
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)pyrazol-3-amine?
The IUPAC name of 1-(2-methoxyethyl)pyrazol-3-amine (CID 45116728) is 1-(2-methoxyethyl)pyrazol-3-amine.
What is the SMILES notation for 1-(2-methoxyethyl)pyrazol-3-amine?
The canonical SMILES for 1-(2-methoxyethyl)pyrazol-3-amine is COCCn1ccc(N)n1.
What is the InChIKey of 1-(2-methoxyethyl)pyrazol-3-amine?
The InChIKey is CIZWSGSWDKEWQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-10-5-4-9-3-2-6(7)8-9/h2-3H,4-5H2,1H3,(H2,7,8).
What are the key properties of 1-(2-methoxyethyl)pyrazol-3-amine?
1-(2-methoxyethyl)pyrazol-3-amine has a molecular weight of 141.17 g/mol, XLogP of 0.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)pyrazol-3-amine is sourced from PubChem (CID 45116728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).