N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide

C9H15F3N2O — CID 167751504

IUPACN,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide
SMILESCNC(=O)N1CCC(C(F)(F)F)CC1C
InChIInChI=1S/C9H15F3N2O/c1-6-5-7(9(10,11)12)3-4-14(6)8(15)13-2/h6-7H,3-5H2,1-2H3,(H,13,15)
InChIKeyHJXNRRNAVQVQJK-UHFFFAOYSA-N
MW224.23 g/mol
LogP1.99
Rot. Bonds

About N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide

N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide (PubChem CID 167751504) has the molecular formula C9H15F3N2O and a molecular weight of 224.23 g/mol. Its IUPAC name is N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide
PubChem CID167751504
Molecular FormulaC9H15F3N2O
Molecular Weight224.23 g/mol
Exact Mass224.11
IUPAC NameN,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide
SMILESCNC(=O)N1CCC(C(F)(F)F)CC1C
InChIInChI=1S/C9H15F3N2O/c1-6-5-7(9(10,11)12)3-4-14(6)8(15)13-2/h6-7H,3-5H2,1-2H3,(H,13,15)
InChIKeyHJXNRRNAVQVQJK-UHFFFAOYSA-N
XLogP1.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.23
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide?
The IUPAC name of N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide (CID 167751504) is N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide.
What is the SMILES notation for N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide?
The canonical SMILES for N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide is CNC(=O)N1CCC(C(F)(F)F)CC1C.
What is the InChIKey of N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide?
The InChIKey is HJXNRRNAVQVQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3N2O/c1-6-5-7(9(10,11)12)3-4-14(6)8(15)13-2/h6-7H,3-5H2,1-2H3,(H,13,15).
What are the key properties of N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide?
N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide has a molecular weight of 224.23 g/mol, XLogP of 1.99, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide is sourced from PubChem (CID 167751504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).