N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide

C15H25F3N2O — CID 114908814

IUPACN-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESCC(NC(=O)C1CCC(C(F)(F)F)CN1)C1CCCCC1
InChIInChI=1S/C15H25F3N2O/c1-10(11-5-3-2-4-6-11)20-14(21)13-8-7-12(9-19-13)15(16,17)18/h10-13,19H,2-9H2,1H3,(H,20,21)
InChIKeySELGTXUDJXJQFF-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.00
Rot. Bonds3

About N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide

N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide (PubChem CID 114908814) has the molecular formula C15H25F3N2O and a molecular weight of 306.37 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide
PubChem CID114908814
Molecular FormulaC15H25F3N2O
Molecular Weight306.37 g/mol
Exact Mass306.19
IUPAC NameN-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESCC(NC(=O)C1CCC(C(F)(F)F)CN1)C1CCCCC1
InChIInChI=1S/C15H25F3N2O/c1-10(11-5-3-2-4-6-11)20-14(21)13-8-7-12(9-19-13)15(16,17)18/h10-13,19H,2-9H2,1H3,(H,20,21)
InChIKeySELGTXUDJXJQFF-UHFFFAOYSA-N
XLogP3.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-methylhexan-2-yl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908871
N-[(1S)-1-cyclopentylethyl]azepane-2-carboxamide
CID 81390656
N-(1-methylcyclohexyl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908781
N-heptan-2-yl-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908717
(2S)-N-[(1S)-1-cyclopentylethyl]pyrrolidine-2-carboxamide
CID 81388860
(2R)-N-[(1R)-1-cyclopentylethyl]piperidine-2-carboxamide
CID 104914395
N-[(1S)-1-cyclopentylethyl]-4-hydroxypyrrolidine-2-carboxamide
CID 81391568
N-piperidin-1-yl-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908961
N-[(1S)-1-cyclopentylethyl]-4-methoxypyrrolidine-2-carboxamide
CID 81389076
N-(2-ethylcyclohexyl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908719
N-(2,2,3,3-tetrafluoropropyl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 106293083
N-[(1S)-1-cyclohexylethyl]thiomorpholine-3-carboxamide
CID 82918098

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide?
The IUPAC name of N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide (CID 114908814) is N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide.
What is the SMILES notation for N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide?
The canonical SMILES for N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide is CC(NC(=O)C1CCC(C(F)(F)F)CN1)C1CCCCC1.
What is the InChIKey of N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide?
The InChIKey is SELGTXUDJXJQFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3N2O/c1-10(11-5-3-2-4-6-11)20-14(21)13-8-7-12(9-19-13)15(16,17)18/h10-13,19H,2-9H2,1H3,(H,20,21).
What are the key properties of N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide?
N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide is sourced from PubChem (CID 114908814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).