3,3-difluoropiperidine-1-carboxamide

C6H10F2N2O — CID 89026210

IUPAC3,3-difluoropiperidine-1-carboxamide
SMILESNC(=O)N1CCCC(F)(F)C1
InChIInChI=1S/C6H10F2N2O/c7-6(8)2-1-3-10(4-6)5(9)11/h1-4H2,(H2,9,11)
InChIKeyJOUBVHCHAAQKDL-UHFFFAOYSA-N
MW164.16 g/mol
LogP0.80
Rot. Bonds

About 3,3-difluoropiperidine-1-carboxamide

3,3-difluoropiperidine-1-carboxamide (PubChem CID 89026210) has the molecular formula C6H10F2N2O and a molecular weight of 164.16 g/mol. Its IUPAC name is 3,3-difluoropiperidine-1-carboxamide.

Molecular Properties

Compound Name3,3-difluoropiperidine-1-carboxamide
PubChem CID89026210
Molecular FormulaC6H10F2N2O
Molecular Weight164.16 g/mol
Exact Mass164.08
IUPAC Name3,3-difluoropiperidine-1-carboxamide
SMILESNC(=O)N1CCCC(F)(F)C1
InChIInChI=1S/C6H10F2N2O/c7-6(8)2-1-3-10(4-6)5(9)11/h1-4H2,(H2,9,11)
InChIKeyJOUBVHCHAAQKDL-UHFFFAOYSA-N
XLogP0.80
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-Piperidinecarboxamide
CID 72887
(Piperidinoformamido)sulfur pentafluoride
CID 557732
N-(1,1,1,3,3,3-hexafluoropropan-2-yl)piperidine-1-carboxamide
CID 2836448
3-(Trifluoromethyl)piperidine-1-carboxamide
CID 60703187
4-(Trifluoromethyl)piperidine-1-carboxamide
CID 65534456
N-(trifluoromethyl)piperidine-1-carboxamide
CID 108865905
N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
CID 115592891
4,4-Difluoropiperidine-1-carboxamide
CID 116991121
4,4-difluoro-N-methylpiperidine-1-carboxamide
CID 116991122
3,3-difluoro-N-methylpiperidine-1-carboxamide
CID 116991475
2-(Trifluoromethyl)piperidine-1-carboxamide
CID 118139755
N-ethyl-3,3-difluoropiperidine-1-carboxamide
CID 118348635

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoropiperidine-1-carboxamide?
The IUPAC name of 3,3-difluoropiperidine-1-carboxamide (CID 89026210) is 3,3-difluoropiperidine-1-carboxamide.
What is the SMILES notation for 3,3-difluoropiperidine-1-carboxamide?
The canonical SMILES for 3,3-difluoropiperidine-1-carboxamide is NC(=O)N1CCCC(F)(F)C1.
What is the InChIKey of 3,3-difluoropiperidine-1-carboxamide?
The InChIKey is JOUBVHCHAAQKDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2N2O/c7-6(8)2-1-3-10(4-6)5(9)11/h1-4H2,(H2,9,11).
What are the key properties of 3,3-difluoropiperidine-1-carboxamide?
3,3-difluoropiperidine-1-carboxamide has a molecular weight of 164.16 g/mol, XLogP of 0.80, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoropiperidine-1-carboxamide is sourced from PubChem (CID 89026210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).