1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide

C11H19F3N4O2 — CID 63571650

IUPAC1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide
SMILESCN(CC(=O)N1CCC(C(=O)NN)CC1)CC(F)(F)F
InChIInChI=1S/C11H19F3N4O2/c1-17(7-11(12,13)14)6-9(19)18-4-2-8(3-5-18)10(20)16-15/h8H,2-7,15H2,1H3,(H,16,20)
InChIKeyFSDKNLLMPYUPGQ-UHFFFAOYSA-N
MW296.29 g/mol
LogP-0.29
Rot. Bonds4

About 1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide

1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide (PubChem CID 63571650) has the molecular formula C11H19F3N4O2 and a molecular weight of 296.29 g/mol. Its IUPAC name is 1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide
PubChem CID63571650
Molecular FormulaC11H19F3N4O2
Molecular Weight296.29 g/mol
Exact Mass296.15
IUPAC Name1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide
SMILESCN(CC(=O)N1CCC(C(=O)NN)CC1)CC(F)(F)F
InChIInChI=1S/C11H19F3N4O2/c1-17(7-11(12,13)14)6-9(19)18-4-2-8(3-5-18)10(20)16-15/h8H,2-7,15H2,1H3,(H,16,20)
InChIKeyFSDKNLLMPYUPGQ-UHFFFAOYSA-N
XLogP-0.29
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.29
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'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-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide?
The IUPAC name of 1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide (CID 63571650) is 1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide.
What is the SMILES notation for 1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide?
The canonical SMILES for 1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide is CN(CC(=O)N1CCC(C(=O)NN)CC1)CC(F)(F)F.
What is the InChIKey of 1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide?
The InChIKey is FSDKNLLMPYUPGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N4O2/c1-17(7-11(12,13)14)6-9(19)18-4-2-8(3-5-18)10(20)16-15/h8H,2-7,15H2,1H3,(H,16,20).
What are the key properties of 1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide?
1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide has a molecular weight of 296.29 g/mol, XLogP of -0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[methyl(2,2,2-trifluoroethyl)amino]acetyl]piperidine-4-carbohydrazide is sourced from PubChem (CID 63571650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).