[6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine

C10H15N7 — CID 80902698

IUPAC[6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine
SMILESCCc1nc(CC)n(-c2cc(NN)ncn2)n1
InChIInChI=1S/C10H15N7/c1-3-7-14-9(4-2)17(16-7)10-5-8(15-11)12-6-13-10/h5-6H,3-4,11H2,1-2H3,(H,12,13,15)
InChIKeyYWKVEJYGVOLDDB-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.47
Rot. Bonds4

About [6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine

[6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine (PubChem CID 80902698) has the molecular formula C10H15N7 and a molecular weight of 233.28 g/mol. Its IUPAC name is [6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine
PubChem CID80902698
Molecular FormulaC10H15N7
Molecular Weight233.28 g/mol
Exact Mass233.14
IUPAC Name[6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine
SMILESCCc1nc(CC)n(-c2cc(NN)ncn2)n1
InChIInChI=1S/C10H15N7/c1-3-7-14-9(4-2)17(16-7)10-5-8(15-11)12-6-13-10/h5-6H,3-4,11H2,1-2H3,(H,12,13,15)
InChIKeyYWKVEJYGVOLDDB-UHFFFAOYSA-N
XLogP0.47
TPSA94.54 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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 [6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine (CID 80902698) is [6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine is CCc1nc(CC)n(-c2cc(NN)ncn2)n1.
What is the InChIKey of [6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine?
The InChIKey is YWKVEJYGVOLDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N7/c1-3-7-14-9(4-2)17(16-7)10-5-8(15-11)12-6-13-10/h5-6H,3-4,11H2,1-2H3,(H,12,13,15).
What are the key properties of [6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine?
[6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine has a molecular weight of 233.28 g/mol, XLogP of 0.47, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3,5-diethyl-1,2,4-triazol-1-yl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80902698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).