[4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine

C13H20N8 — CID 80938606

IUPAC[4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine
SMILESCCC1CCCCN1c1nc(NN)nc(-n2cccn2)n1
InChIInChI=1S/C13H20N8/c1-2-10-6-3-4-8-20(10)12-16-11(19-14)17-13(18-12)21-9-5-7-15-21/h5,7,9-10H,2-4,6,8,14H2,1H3,(H,16,17,18,19)
InChIKeyMGXFJSVTASGXED-UHFFFAOYSA-N
MW288.36 g/mol
LogP1.11
Rot. Bonds4

About [4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine

[4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine (PubChem CID 80938606) has the molecular formula C13H20N8 and a molecular weight of 288.36 g/mol. Its IUPAC name is [4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine
PubChem CID80938606
Molecular FormulaC13H20N8
Molecular Weight288.36 g/mol
Exact Mass288.18
IUPAC Name[4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine
SMILESCCC1CCCCN1c1nc(NN)nc(-n2cccn2)n1
InChIInChI=1S/C13H20N8/c1-2-10-6-3-4-8-20(10)12-16-11(19-14)17-13(18-12)21-9-5-7-15-21/h5,7,9-10H,2-4,6,8,14H2,1H3,(H,16,17,18,19)
InChIKeyMGXFJSVTASGXED-UHFFFAOYSA-N
XLogP1.11
TPSA97.78 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.36
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

4-(2-ethylpiperidin-1-yl)-N-methyl-6-pyrazol-1-yl-1,3,5-triazin-2-amine
CID 80770964
[4-(2-ethyl-5-methylpyrrolidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 83171913
4-(2-ethylazepan-1-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 104693151
[1-(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)piperidin-2-yl]methanol
CID 80794266
[4-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 115563123
4-hydrazinyl-N-(2-methylcyclohexyl)-6-pyrazol-1-yl-1,3,5-triazin-2-amine
CID 80938213
N-cyclobutyl-4-hydrazinyl-6-pyrazol-1-yl-1,3,5-triazin-2-amine
CID 80919597
[4-(2,2-dimethylpyrrolidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 80914010
(4-cyclobutyloxy-6-pyrazol-1-yl-1,3,5-triazin-2-yl)hydrazine
CID 80930532
N-ethyl-4-(2-ethylpyrrolidin-1-yl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80774727
2-ethyl-2-[(4-hydrazinyl-6-pyrazol-1-yl-1,3,5-triazin-2-yl)amino]butan-1-ol
CID 80902539
4-N,4-N-diethyl-6-(2-ethylpiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine
CID 80773407

Frequently Asked Questions

What is the IUPAC name of [4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine?
The IUPAC name of [4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine (CID 80938606) is [4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine.
What is the SMILES notation for [4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine?
The canonical SMILES for [4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine is CCC1CCCCN1c1nc(NN)nc(-n2cccn2)n1.
What is the InChIKey of [4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine?
The InChIKey is MGXFJSVTASGXED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N8/c1-2-10-6-3-4-8-20(10)12-16-11(19-14)17-13(18-12)21-9-5-7-15-21/h5,7,9-10H,2-4,6,8,14H2,1H3,(H,16,17,18,19).
What are the key properties of [4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine?
[4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine has a molecular weight of 288.36 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-ethylpiperidin-1-yl)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine is sourced from PubChem (CID 80938606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).