[4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine

C14H21F3N4 — CID 102721159

IUPAC[4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine
SMILESCC1CC(C)C(C)N(c2cc(C(F)(F)F)cc(NN)n2)C1
InChIInChI=1S/C14H21F3N4/c1-8-4-9(2)10(3)21(7-8)13-6-11(14(15,16)17)5-12(19-13)20-18/h5-6,8-10H,4,7,18H2,1-3H3,(H,19,20)
InChIKeyPISMSGMMWQUBOZ-UHFFFAOYSA-N
MW302.34 g/mol
LogP3.26
Rot. Bonds2

About [4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine

[4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine (PubChem CID 102721159) has the molecular formula C14H21F3N4 and a molecular weight of 302.34 g/mol. Its IUPAC name is [4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine
PubChem CID102721159
Molecular FormulaC14H21F3N4
Molecular Weight302.34 g/mol
Exact Mass302.17
IUPAC Name[4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine
SMILESCC1CC(C)C(C)N(c2cc(C(F)(F)F)cc(NN)n2)C1
InChIInChI=1S/C14H21F3N4/c1-8-4-9(2)10(3)21(7-8)13-6-11(14(15,16)17)5-12(19-13)20-18/h5-6,8-10H,4,7,18H2,1-3H3,(H,19,20)
InChIKeyPISMSGMMWQUBOZ-UHFFFAOYSA-N
XLogP3.26
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine?
The IUPAC name of [4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine (CID 102721159) is [4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine.
What is the SMILES notation for [4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine?
The canonical SMILES for [4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine is CC1CC(C)C(C)N(c2cc(C(F)(F)F)cc(NN)n2)C1.
What is the InChIKey of [4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine?
The InChIKey is PISMSGMMWQUBOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21F3N4/c1-8-4-9(2)10(3)21(7-8)13-6-11(14(15,16)17)5-12(19-13)20-18/h5-6,8-10H,4,7,18H2,1-3H3,(H,19,20).
What are the key properties of [4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine?
[4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine has a molecular weight of 302.34 g/mol, XLogP of 3.26, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(trifluoromethyl)-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine is sourced from PubChem (CID 102721159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).