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

C6H11N3O — CID 170375977

IUPAC4-methoxy-N,1-dimethylpyrazol-3-amine
SMILESCNc1nn(C)cc1OC
InChIInChI=1S/C6H11N3O/c1-7-6-5(10-3)4-9(2)8-6/h4H,1-3H3,(H,7,8)
InChIKeyWQLLBUBNAITSCZ-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.47
Rot. Bonds2

About 4-methoxy-N,1-dimethylpyrazol-3-amine

4-methoxy-N,1-dimethylpyrazol-3-amine (PubChem CID 170375977) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 4-methoxy-N,1-dimethylpyrazol-3-amine.

Molecular Properties

Compound Name4-methoxy-N,1-dimethylpyrazol-3-amine
PubChem CID170375977
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name4-methoxy-N,1-dimethylpyrazol-3-amine
SMILESCNc1nn(C)cc1OC
InChIInChI=1S/C6H11N3O/c1-7-6-5(10-3)4-9(2)8-6/h4H,1-3H3,(H,7,8)
InChIKeyWQLLBUBNAITSCZ-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 4-methoxy-N,1-dimethylpyrazol-3-amine?
The IUPAC name of 4-methoxy-N,1-dimethylpyrazol-3-amine (CID 170375977) is 4-methoxy-N,1-dimethylpyrazol-3-amine.
What is the SMILES notation for 4-methoxy-N,1-dimethylpyrazol-3-amine?
The canonical SMILES for 4-methoxy-N,1-dimethylpyrazol-3-amine is CNc1nn(C)cc1OC.
What is the InChIKey of 4-methoxy-N,1-dimethylpyrazol-3-amine?
The InChIKey is WQLLBUBNAITSCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-7-6-5(10-3)4-9(2)8-6/h4H,1-3H3,(H,7,8).
What are the key properties of 4-methoxy-N,1-dimethylpyrazol-3-amine?
4-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 4-methoxy-N,1-dimethylpyrazol-3-amine is sourced from PubChem (CID 170375977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).