[1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine

C13H26N4O — CID 105339861

IUPAC[1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine
SMILESCCCn1ncc(OC)c1C(NN)C(C)C(C)C
InChIInChI=1S/C13H26N4O/c1-6-7-17-13(11(18-5)8-15-17)12(16-14)10(4)9(2)3/h8-10,12,16H,6-7,14H2,1-5H3
InChIKeyABWHHEALXKWRMO-UHFFFAOYSA-N
MW254.38 g/mol
LogP2.10
Rot. Bonds7

About [1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine

[1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine (PubChem CID 105339861) has the molecular formula C13H26N4O and a molecular weight of 254.38 g/mol. Its IUPAC name is [1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine
PubChem CID105339861
Molecular FormulaC13H26N4O
Molecular Weight254.38 g/mol
Exact Mass254.21
IUPAC Name[1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine
SMILESCCCn1ncc(OC)c1C(NN)C(C)C(C)C
InChIInChI=1S/C13H26N4O/c1-6-7-17-13(11(18-5)8-15-17)12(16-14)10(4)9(2)3/h8-10,12,16H,6-7,14H2,1-5H3
InChIKeyABWHHEALXKWRMO-UHFFFAOYSA-N
XLogP2.10
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine?
The IUPAC name of [1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine (CID 105339861) is [1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine.
What is the SMILES notation for [1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine?
The canonical SMILES for [1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine is CCCn1ncc(OC)c1C(NN)C(C)C(C)C.
What is the InChIKey of [1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine?
The InChIKey is ABWHHEALXKWRMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O/c1-6-7-17-13(11(18-5)8-15-17)12(16-14)10(4)9(2)3/h8-10,12,16H,6-7,14H2,1-5H3.
What are the key properties of [1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine?
[1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine has a molecular weight of 254.38 g/mol, XLogP of 2.10, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine is sourced from PubChem (CID 105339861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).