N-ethyl-3,3-difluoropiperidine-1-carboxamide

C8H14F2N2O — CID 118348635

IUPACN-ethyl-3,3-difluoropiperidine-1-carboxamide
SMILESCCNC(=O)N1CCCC(F)(F)C1
InChIInChI=1S/C8H14F2N2O/c1-2-11-7(13)12-5-3-4-8(9,10)6-12/h2-6H2,1H3,(H,11,13)
InChIKeyAJQRAVILIVTDPE-UHFFFAOYSA-N
MW192.21 g/mol
LogP1.45
Rot. Bonds1

About N-ethyl-3,3-difluoropiperidine-1-carboxamide

N-ethyl-3,3-difluoropiperidine-1-carboxamide (PubChem CID 118348635) has the molecular formula C8H14F2N2O and a molecular weight of 192.21 g/mol. Its IUPAC name is N-ethyl-3,3-difluoropiperidine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-3,3-difluoropiperidine-1-carboxamide
PubChem CID118348635
Molecular FormulaC8H14F2N2O
Molecular Weight192.21 g/mol
Exact Mass192.11
IUPAC NameN-ethyl-3,3-difluoropiperidine-1-carboxamide
SMILESCCNC(=O)N1CCCC(F)(F)C1
InChIInChI=1S/C8H14F2N2O/c1-2-11-7(13)12-5-3-4-8(9,10)6-12/h2-6H2,1H3,(H,11,13)
InChIKeyAJQRAVILIVTDPE-UHFFFAOYSA-N
XLogP1.45
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.21
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,3-difluoropiperidine-1-carboxamide?
The IUPAC name of N-ethyl-3,3-difluoropiperidine-1-carboxamide (CID 118348635) is N-ethyl-3,3-difluoropiperidine-1-carboxamide.
What is the SMILES notation for N-ethyl-3,3-difluoropiperidine-1-carboxamide?
The canonical SMILES for N-ethyl-3,3-difluoropiperidine-1-carboxamide is CCNC(=O)N1CCCC(F)(F)C1.
What is the InChIKey of N-ethyl-3,3-difluoropiperidine-1-carboxamide?
The InChIKey is AJQRAVILIVTDPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2N2O/c1-2-11-7(13)12-5-3-4-8(9,10)6-12/h2-6H2,1H3,(H,11,13).
What are the key properties of N-ethyl-3,3-difluoropiperidine-1-carboxamide?
N-ethyl-3,3-difluoropiperidine-1-carboxamide has a molecular weight of 192.21 g/mol, XLogP of 1.45, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,3-difluoropiperidine-1-carboxamide is sourced from PubChem (CID 118348635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).