2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide

C13H17FN2O — CID 174528127

IUPAC2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide
SMILESO=C(CF)NC1CNCC(c2ccccc2)C1
InChIInChI=1S/C13H17FN2O/c14-7-13(17)16-12-6-11(8-15-9-12)10-4-2-1-3-5-10/h1-5,11-12,15H,6-9H2,(H,16,17)
InChIKeyBVHILXHYXMKCGT-UHFFFAOYSA-N
MW236.29 g/mol
LogP1.22
Rot. Bonds3

About 2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide

2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide (PubChem CID 174528127) has the molecular formula C13H17FN2O and a molecular weight of 236.29 g/mol. Its IUPAC name is 2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide
PubChem CID174528127
Molecular FormulaC13H17FN2O
Molecular Weight236.29 g/mol
Exact Mass236.13
IUPAC Name2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide
SMILESO=C(CF)NC1CNCC(c2ccccc2)C1
InChIInChI=1S/C13H17FN2O/c14-7-13(17)16-12-6-11(8-15-9-12)10-4-2-1-3-5-10/h1-5,11-12,15H,6-9H2,(H,16,17)
InChIKeyBVHILXHYXMKCGT-UHFFFAOYSA-N
XLogP1.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.29
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide?
The IUPAC name of 2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide (CID 174528127) is 2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide.
What is the SMILES notation for 2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide?
The canonical SMILES for 2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide is O=C(CF)NC1CNCC(c2ccccc2)C1.
What is the InChIKey of 2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide?
The InChIKey is BVHILXHYXMKCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O/c14-7-13(17)16-12-6-11(8-15-9-12)10-4-2-1-3-5-10/h1-5,11-12,15H,6-9H2,(H,16,17).
What are the key properties of 2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide?
2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide has a molecular weight of 236.29 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(5-phenylpiperidin-3-yl)acetamide is sourced from PubChem (CID 174528127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).