N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide

C11H19F3N2O — CID 114908623

IUPACN-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESCCCN(C)C(=O)C1CCC(C(F)(F)F)CN1
InChIInChI=1S/C11H19F3N2O/c1-3-6-16(2)10(17)9-5-4-8(7-15-9)11(12,13)14/h8-9,15H,3-7H2,1-2H3
InChIKeyJBLOMNBIWXOPJK-UHFFFAOYSA-N
MW252.28 g/mol
LogP1.79
Rot. Bonds3

About N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide

N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide (PubChem CID 114908623) has the molecular formula C11H19F3N2O and a molecular weight of 252.28 g/mol. Its IUPAC name is N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide
PubChem CID114908623
Molecular FormulaC11H19F3N2O
Molecular Weight252.28 g/mol
Exact Mass252.14
IUPAC NameN-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESCCCN(C)C(=O)C1CCC(C(F)(F)F)CN1
InChIInChI=1S/C11H19F3N2O/c1-3-6-16(2)10(17)9-5-4-8(7-15-9)11(12,13)14/h8-9,15H,3-7H2,1-2H3
InChIKeyJBLOMNBIWXOPJK-UHFFFAOYSA-N
XLogP1.79
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(4-methylpentan-2-yl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908749
N-cyclopentyl-N-ethyl-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908640
N-(1-methoxypropan-2-yl)-N-methyl-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908709
(2S)-N-methyl-N-propylpyrrolidine-2-carboxamide
CID 54558702
(2R)-N-methyl-N-propylpiperidine-2-carboxamide
CID 93272806
2,2-dimethyl-1-[5-(trifluoromethyl)piperidin-2-yl]propan-1-one
CID 176833678
N-(3-ethylpentan-3-yl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908898
N-ethyl-N-(oxolan-2-ylmethyl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908699
(2S)-N-methyl-N-pentylaziridine-2-carboxamide
CID 170218604
methyl 5-(trifluoromethyl)piperidine-2-carboxylate;hydrochloride
CID 164886197
N-methyl-N-(3-methylphenyl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908798
N-[3-(dimethylamino)-2,2-dimethylpropyl]-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908525

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide?
The IUPAC name of N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide (CID 114908623) is N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide.
What is the SMILES notation for N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide?
The canonical SMILES for N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide is CCCN(C)C(=O)C1CCC(C(F)(F)F)CN1.
What is the InChIKey of N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide?
The InChIKey is JBLOMNBIWXOPJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O/c1-3-6-16(2)10(17)9-5-4-8(7-15-9)11(12,13)14/h8-9,15H,3-7H2,1-2H3.
What are the key properties of N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide?
N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide has a molecular weight of 252.28 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propyl-5-(trifluoromethyl)piperidine-2-carboxamide is sourced from PubChem (CID 114908623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).