5-methoxy-N,1-dimethylpyrazol-3-amine

C6H11N3O — CID 18724717

IUPAC5-methoxy-N,1-dimethylpyrazol-3-amine
SMILESCNc1cc(OC)n(C)n1
InChIInChI=1S/C6H11N3O/c1-7-5-4-6(10-3)9(2)8-5/h4H,1-3H3,(H,7,8)
InChIKeyRUDQEJFIWJGWSY-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.47
Rot. Bonds2

About 5-methoxy-N,1-dimethylpyrazol-3-amine

5-methoxy-N,1-dimethylpyrazol-3-amine (PubChem CID 18724717) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 5-methoxy-N,1-dimethylpyrazol-3-amine.

Molecular Properties

Compound Name5-methoxy-N,1-dimethylpyrazol-3-amine
PubChem CID18724717
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name5-methoxy-N,1-dimethylpyrazol-3-amine
SMILESCNc1cc(OC)n(C)n1
InChIInChI=1S/C6H11N3O/c1-7-5-4-6(10-3)9(2)8-5/h4H,1-3H3,(H,7,8)
InChIKeyRUDQEJFIWJGWSY-UHFFFAOYSA-N
XLogP0.47
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N,1-dimethylpyrazol-3-amine?
The IUPAC name of 5-methoxy-N,1-dimethylpyrazol-3-amine (CID 18724717) is 5-methoxy-N,1-dimethylpyrazol-3-amine.
What is the SMILES notation for 5-methoxy-N,1-dimethylpyrazol-3-amine?
The canonical SMILES for 5-methoxy-N,1-dimethylpyrazol-3-amine is CNc1cc(OC)n(C)n1.
What is the InChIKey of 5-methoxy-N,1-dimethylpyrazol-3-amine?
The InChIKey is RUDQEJFIWJGWSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-7-5-4-6(10-3)9(2)8-5/h4H,1-3H3,(H,7,8).
What are the key properties of 5-methoxy-N,1-dimethylpyrazol-3-amine?
5-methoxy-N,1-dimethylpyrazol-3-amine has a molecular weight of 141.17 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N,1-dimethylpyrazol-3-amine is sourced from PubChem (CID 18724717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).