[1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine

C13H22N6 — CID 103025805

IUPAC[1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
SMILESCCc1cc(C(CCc2cnn(C)c2)NN)n(C)n1
InChIInChI=1S/C13H22N6/c1-4-11-7-13(19(3)17-11)12(16-14)6-5-10-8-15-18(2)9-10/h7-9,12,16H,4-6,14H2,1-3H3
InChIKeyDQYCEFGHSPWYOT-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.85
Rot. Bonds6

About [1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine

[1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine (PubChem CID 103025805) has the molecular formula C13H22N6 and a molecular weight of 262.36 g/mol. Its IUPAC name is [1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
PubChem CID103025805
Molecular FormulaC13H22N6
Molecular Weight262.36 g/mol
Exact Mass262.19
IUPAC Name[1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
SMILESCCc1cc(C(CCc2cnn(C)c2)NN)n(C)n1
InChIInChI=1S/C13H22N6/c1-4-11-7-13(19(3)17-11)12(16-14)6-5-10-8-15-18(2)9-10/h7-9,12,16H,4-6,14H2,1-3H3
InChIKeyDQYCEFGHSPWYOT-UHFFFAOYSA-N
XLogP0.85
TPSA73.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine?
The IUPAC name of [1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine (CID 103025805) is [1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine.
What is the SMILES notation for [1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine?
The canonical SMILES for [1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine is CCc1cc(C(CCc2cnn(C)c2)NN)n(C)n1.
What is the InChIKey of [1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine?
The InChIKey is DQYCEFGHSPWYOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N6/c1-4-11-7-13(19(3)17-11)12(16-14)6-5-10-8-15-18(2)9-10/h7-9,12,16H,4-6,14H2,1-3H3.
What are the key properties of [1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine?
[1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine has a molecular weight of 262.36 g/mol, XLogP of 0.85, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine is sourced from PubChem (CID 103025805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).