2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide

C8H13F3N2O — CID 137468593

IUPAC2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide
SMILESNC(=O)C1(C(F)(F)CF)CCCCN1
InChIInChI=1S/C8H13F3N2O/c9-5-8(10,11)7(6(12)14)3-1-2-4-13-7/h13H,1-5H2,(H2,12,14)
InChIKeyQQTFQUZYUFQGOR-UHFFFAOYSA-N
MW210.20 g/mol
LogP0.59
Rot. Bonds3

About 2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide

2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide (PubChem CID 137468593) has the molecular formula C8H13F3N2O and a molecular weight of 210.20 g/mol. Its IUPAC name is 2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide
PubChem CID137468593
Molecular FormulaC8H13F3N2O
Molecular Weight210.20 g/mol
Exact Mass210.10
IUPAC Name2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide
SMILESNC(=O)C1(C(F)(F)CF)CCCCN1
InChIInChI=1S/C8H13F3N2O/c9-5-8(10,11)7(6(12)14)3-1-2-4-13-7/h13H,1-5H2,(H2,12,14)
InChIKeyQQTFQUZYUFQGOR-UHFFFAOYSA-N
XLogP0.59
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.20
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide?
The IUPAC name of 2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide (CID 137468593) is 2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide.
What is the SMILES notation for 2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide?
The canonical SMILES for 2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide is NC(=O)C1(C(F)(F)CF)CCCCN1.
What is the InChIKey of 2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide?
The InChIKey is QQTFQUZYUFQGOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F3N2O/c9-5-8(10,11)7(6(12)14)3-1-2-4-13-7/h13H,1-5H2,(H2,12,14).
What are the key properties of 2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide?
2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide has a molecular weight of 210.20 g/mol, XLogP of 0.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1,2-trifluoroethyl)piperidine-2-carboxamide is sourced from PubChem (CID 137468593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).