N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide

C13H15F3N2O2 — CID 60927756

IUPACN-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide
SMILESO=C(Nc1ccc(OC(F)F)c(F)c1)C1CCCCN1
InChIInChI=1S/C13H15F3N2O2/c14-9-7-8(4-5-11(9)20-13(15)16)18-12(19)10-3-1-2-6-17-10/h4-5,7,10,13,17H,1-3,6H2,(H,18,19)
InChIKeyYXEUTTBYEOGOLM-UHFFFAOYSA-N
MW288.27 g/mol
LogP2.51
Rot. Bonds4

About N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide

N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide (PubChem CID 60927756) has the molecular formula C13H15F3N2O2 and a molecular weight of 288.27 g/mol. Its IUPAC name is N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide
PubChem CID60927756
Molecular FormulaC13H15F3N2O2
Molecular Weight288.27 g/mol
Exact Mass288.11
IUPAC NameN-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide
SMILESO=C(Nc1ccc(OC(F)F)c(F)c1)C1CCCCN1
InChIInChI=1S/C13H15F3N2O2/c14-9-7-8(4-5-11(9)20-13(15)16)18-12(19)10-3-1-2-6-17-10/h4-5,7,10,13,17H,1-3,6H2,(H,18,19)
InChIKeyYXEUTTBYEOGOLM-UHFFFAOYSA-N
XLogP2.51
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.27
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-cyclopentyloxy-3-fluorophenyl)pyrrolidine-2-carboxamide
CID 119336640
(2R)-N-[3-(difluoromethoxy)-4-methoxyphenyl]pyrrolidine-2-carboxamide
CID 103794468
N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-4-carboxamide
CID 60927755
N-(3,4-difluorophenyl)pyrrolidine-2-carboxamide
CID 18073046
(2S,4S)-N-[4-(difluoromethoxy)-3-fluorophenyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120623737
(2R)-N-(4-methoxy-3-methylphenyl)piperidine-2-carboxamide
CID 94222952
(2S)-N-(3,4,5-trifluorophenyl)piperidine-2-carboxamide
CID 113266184
N-(3-bromo-4-fluorophenyl)piperidine-2-carboxamide
CID 115733745
N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide
CID 62814041
(2R)-N-(3,4,5-trifluorophenyl)piperidine-2-carboxamide;hydrochloride
CID 119707989
N-(3,4,5-trifluorophenyl)azepane-2-carboxamide
CID 64569548
N-(3,4-dimethoxyphenyl)azepane-2-carboxamide
CID 64562794

Frequently Asked Questions

What is the IUPAC name of N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide?
The IUPAC name of N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide (CID 60927756) is N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide?
The canonical SMILES for N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide is O=C(Nc1ccc(OC(F)F)c(F)c1)C1CCCCN1.
What is the InChIKey of N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide?
The InChIKey is YXEUTTBYEOGOLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F3N2O2/c14-9-7-8(4-5-11(9)20-13(15)16)18-12(19)10-3-1-2-6-17-10/h4-5,7,10,13,17H,1-3,6H2,(H,18,19).
What are the key properties of N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide?
N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide has a molecular weight of 288.27 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(difluoromethoxy)-3-fluorophenyl]piperidine-2-carboxamide is sourced from PubChem (CID 60927756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).