4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide

C11H18F4N2O2 — CID 106291735

IUPAC4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NCC(F)(F)C(F)F)CCNCC1
InChIInChI=1S/C11H18F4N2O2/c1-19-7-10(2-4-16-5-3-10)9(18)17-6-11(14,15)8(12)13/h8,16H,2-7H2,1H3,(H,17,18)
InChIKeyBQWLXJCABSJKBA-UHFFFAOYSA-N
MW286.27 g/mol
LogP1.02
Rot. Bonds6

About 4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide

4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide (PubChem CID 106291735) has the molecular formula C11H18F4N2O2 and a molecular weight of 286.27 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide
PubChem CID106291735
Molecular FormulaC11H18F4N2O2
Molecular Weight286.27 g/mol
Exact Mass286.13
IUPAC Name4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NCC(F)(F)C(F)F)CCNCC1
InChIInChI=1S/C11H18F4N2O2/c1-19-7-10(2-4-16-5-3-10)9(18)17-6-11(14,15)8(12)13/h8,16H,2-7H2,1H3,(H,17,18)
InChIKeyBQWLXJCABSJKBA-UHFFFAOYSA-N
XLogP1.02
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.27
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxy-2-methylpropyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 114042041
4-(methoxymethyl)-N-(4,4,4-trifluorobutyl)piperidine-4-carboxamide;hydrochloride
CID 120632253
N-ethyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616337
N-(3-amino-2-hydroxy-3-oxopropyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 114154115
N-[2-(2-chlorophenyl)-2-methylpropyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120630764
4-(methoxymethyl)-N-(3-methylbut-2-enyl)piperidine-4-carboxamide
CID 106187178
N-[2-(3-fluorophenyl)-2-methylpropyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120634720
N-(5,5-dimethylhexan-2-yl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120634804
4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide
CID 106391030
N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-4-(methoxymethyl)piperidine-4-carboxamide;dihydrochloride
CID 120640871
N-[2-(3,5-difluorophenyl)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120628206
N-(1,3-dihydroxy-2-methylpropan-2-yl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 114042054

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide?
The IUPAC name of 4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide (CID 106291735) is 4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide.
What is the SMILES notation for 4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide?
The canonical SMILES for 4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide is COCC1(C(=O)NCC(F)(F)C(F)F)CCNCC1.
What is the InChIKey of 4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide?
The InChIKey is BQWLXJCABSJKBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F4N2O2/c1-19-7-10(2-4-16-5-3-10)9(18)17-6-11(14,15)8(12)13/h8,16H,2-7H2,1H3,(H,17,18).
What are the key properties of 4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide?
4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide has a molecular weight of 286.27 g/mol, XLogP of 1.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-(2,2,3,3-tetrafluoropropyl)piperidine-4-carboxamide is sourced from PubChem (CID 106291735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).