[2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine

C14H19F3N2 — CID 105299132

IUPAC[2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine
SMILESNNC(CC1CCCC1)c1ccccc1C(F)(F)F
InChIInChI=1S/C14H19F3N2/c15-14(16,17)12-8-4-3-7-11(12)13(19-18)9-10-5-1-2-6-10/h3-4,7-8,10,13,19H,1-2,5-6,9,18H2
InChIKeyAEQVJBJWIDELRC-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.79
Rot. Bonds4

About [2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine

[2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine (PubChem CID 105299132) has the molecular formula C14H19F3N2 and a molecular weight of 272.31 g/mol. Its IUPAC name is [2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine
PubChem CID105299132
Molecular FormulaC14H19F3N2
Molecular Weight272.31 g/mol
Exact Mass272.15
IUPAC Name[2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine
SMILESNNC(CC1CCCC1)c1ccccc1C(F)(F)F
InChIInChI=1S/C14H19F3N2/c15-14(16,17)12-8-4-3-7-11(12)13(19-18)9-10-5-1-2-6-10/h3-4,7-8,10,13,19H,1-2,5-6,9,18H2
InChIKeyAEQVJBJWIDELRC-UHFFFAOYSA-N
XLogP3.79
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 [2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine?
The IUPAC name of [2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine (CID 105299132) is [2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine.
What is the SMILES notation for [2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine?
The canonical SMILES for [2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine is NNC(CC1CCCC1)c1ccccc1C(F)(F)F.
What is the InChIKey of [2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine?
The InChIKey is AEQVJBJWIDELRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2/c15-14(16,17)12-8-4-3-7-11(12)13(19-18)9-10-5-1-2-6-10/h3-4,7-8,10,13,19H,1-2,5-6,9,18H2.
What are the key properties of [2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine?
[2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine has a molecular weight of 272.31 g/mol, XLogP of 3.79, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclopentyl-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine is sourced from PubChem (CID 105299132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).