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

C6H11N3O — CID 43554365

IUPAC5-methoxy-1,3-dimethylpyrazol-4-amine
SMILESCOc1c(N)c(C)nn1C
InChIInChI=1S/C6H11N3O/c1-4-5(7)6(10-3)9(2)8-4/h7H2,1-3H3
InChIKeyYGJWTXRSKNXUAY-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.32
Rot. Bonds1

About 5-methoxy-1,3-dimethylpyrazol-4-amine

5-methoxy-1,3-dimethylpyrazol-4-amine (PubChem CID 43554365) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 5-methoxy-1,3-dimethylpyrazol-4-amine.

Molecular Properties

Compound Name5-methoxy-1,3-dimethylpyrazol-4-amine
PubChem CID43554365
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name5-methoxy-1,3-dimethylpyrazol-4-amine
SMILESCOc1c(N)c(C)nn1C
InChIInChI=1S/C6H11N3O/c1-4-5(7)6(10-3)9(2)8-4/h7H2,1-3H3
InChIKeyYGJWTXRSKNXUAY-UHFFFAOYSA-N
XLogP0.32
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1,3-dimethylpyrazol-4-amine?
The IUPAC name of 5-methoxy-1,3-dimethylpyrazol-4-amine (CID 43554365) is 5-methoxy-1,3-dimethylpyrazol-4-amine.
What is the SMILES notation for 5-methoxy-1,3-dimethylpyrazol-4-amine?
The canonical SMILES for 5-methoxy-1,3-dimethylpyrazol-4-amine is COc1c(N)c(C)nn1C.
What is the InChIKey of 5-methoxy-1,3-dimethylpyrazol-4-amine?
The InChIKey is YGJWTXRSKNXUAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-4-5(7)6(10-3)9(2)8-4/h7H2,1-3H3.
What are the key properties of 5-methoxy-1,3-dimethylpyrazol-4-amine?
5-methoxy-1,3-dimethylpyrazol-4-amine has a molecular weight of 141.17 g/mol, XLogP of 0.32, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1,3-dimethylpyrazol-4-amine is sourced from PubChem (CID 43554365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).