5-(3,3-difluoropiperidin-1-yl)pentanamide

C10H18F2N2O — CID 163404267

IUPAC5-(3,3-difluoropiperidin-1-yl)pentanamide
SMILESNC(=O)CCCCN1CCCC(F)(F)C1
InChIInChI=1S/C10H18F2N2O/c11-10(12)5-3-7-14(8-10)6-2-1-4-9(13)15/h1-8H2,(H2,13,15)
InChIKeyXLBOYVNOMBCWAF-UHFFFAOYSA-N
MW220.26 g/mol
LogP1.37
Rot. Bonds5

About 5-(3,3-difluoropiperidin-1-yl)pentanamide

5-(3,3-difluoropiperidin-1-yl)pentanamide (PubChem CID 163404267) has the molecular formula C10H18F2N2O and a molecular weight of 220.26 g/mol. Its IUPAC name is 5-(3,3-difluoropiperidin-1-yl)pentanamide.

Molecular Properties

Compound Name5-(3,3-difluoropiperidin-1-yl)pentanamide
PubChem CID163404267
Molecular FormulaC10H18F2N2O
Molecular Weight220.26 g/mol
Exact Mass220.14
IUPAC Name5-(3,3-difluoropiperidin-1-yl)pentanamide
SMILESNC(=O)CCCCN1CCCC(F)(F)C1
InChIInChI=1S/C10H18F2N2O/c11-10(12)5-3-7-14(8-10)6-2-1-4-9(13)15/h1-8H2,(H2,13,15)
InChIKeyXLBOYVNOMBCWAF-UHFFFAOYSA-N
XLogP1.37
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.26
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(3,3-difluoropiperidin-1-yl)pentanamide?
The IUPAC name of 5-(3,3-difluoropiperidin-1-yl)pentanamide (CID 163404267) is 5-(3,3-difluoropiperidin-1-yl)pentanamide.
What is the SMILES notation for 5-(3,3-difluoropiperidin-1-yl)pentanamide?
The canonical SMILES for 5-(3,3-difluoropiperidin-1-yl)pentanamide is NC(=O)CCCCN1CCCC(F)(F)C1.
What is the InChIKey of 5-(3,3-difluoropiperidin-1-yl)pentanamide?
The InChIKey is XLBOYVNOMBCWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2O/c11-10(12)5-3-7-14(8-10)6-2-1-4-9(13)15/h1-8H2,(H2,13,15).
What are the key properties of 5-(3,3-difluoropiperidin-1-yl)pentanamide?
5-(3,3-difluoropiperidin-1-yl)pentanamide has a molecular weight of 220.26 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,3-difluoropiperidin-1-yl)pentanamide is sourced from PubChem (CID 163404267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).