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

C6H11N3O — CID 170177873

IUPAC3-methoxy-N,1-dimethylpyrazol-4-amine
SMILESCNc1cn(C)nc1OC
InChIInChI=1S/C6H11N3O/c1-7-5-4-9(2)8-6(5)10-3/h4,7H,1-3H3
InChIKeyDTNMZXNTMQRXMW-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.47
Rot. Bonds2

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

3-methoxy-N,1-dimethylpyrazol-4-amine (PubChem CID 170177873) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 3-methoxy-N,1-dimethylpyrazol-4-amine.

Molecular Properties

Compound Name3-methoxy-N,1-dimethylpyrazol-4-amine
PubChem CID170177873
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name3-methoxy-N,1-dimethylpyrazol-4-amine
SMILESCNc1cn(C)nc1OC
InChIInChI=1S/C6H11N3O/c1-7-5-4-9(2)8-6(5)10-3/h4,7H,1-3H3
InChIKeyDTNMZXNTMQRXMW-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 3-methoxy-N,1-dimethylpyrazol-4-amine?
The IUPAC name of 3-methoxy-N,1-dimethylpyrazol-4-amine (CID 170177873) is 3-methoxy-N,1-dimethylpyrazol-4-amine.
What is the SMILES notation for 3-methoxy-N,1-dimethylpyrazol-4-amine?
The canonical SMILES for 3-methoxy-N,1-dimethylpyrazol-4-amine is CNc1cn(C)nc1OC.
What is the InChIKey of 3-methoxy-N,1-dimethylpyrazol-4-amine?
The InChIKey is DTNMZXNTMQRXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-7-5-4-9(2)8-6(5)10-3/h4,7H,1-3H3.
What are the key properties of 3-methoxy-N,1-dimethylpyrazol-4-amine?
3-methoxy-N,1-dimethylpyrazol-4-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 3-methoxy-N,1-dimethylpyrazol-4-amine is sourced from PubChem (CID 170177873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).