2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide

C8H14F2N2O — CID 121184616

IUPAC2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide
SMILESCNC(=O)CN1CCC(F)(F)CC1
InChIInChI=1S/C8H14F2N2O/c1-11-7(13)6-12-4-2-8(9,10)3-5-12/h2-6H2,1H3,(H,11,13)
InChIKeyUDFKKHXSDLJARY-UHFFFAOYSA-N
MW192.21 g/mol
LogP0.46
Rot. Bonds2

About 2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide

2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide (PubChem CID 121184616) has the molecular formula C8H14F2N2O and a molecular weight of 192.21 g/mol. Its IUPAC name is 2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide.

Molecular Properties

Compound Name2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide
PubChem CID121184616
Molecular FormulaC8H14F2N2O
Molecular Weight192.21 g/mol
Exact Mass192.11
IUPAC Name2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide
SMILESCNC(=O)CN1CCC(F)(F)CC1
InChIInChI=1S/C8H14F2N2O/c1-11-7(13)6-12-4-2-8(9,10)3-5-12/h2-6H2,1H3,(H,11,13)
InChIKeyUDFKKHXSDLJARY-UHFFFAOYSA-N
XLogP0.46
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.21
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Piperidineacetamide, N-hexyl-
CID 3063350
N-cyclopentyl-2-[2,2-dimethyl-4-(2,2,2-trifluoroethyl)piperazin-1-yl]acetamide
CID 84598921
N-(2,2-difluoroethyl)-2,2,2-trifluoro-N-(piperidin-3-yl)acetamide
CID 137963851
(2S)-2-amino-1-(4,4-difluoropiperidin-1-yl)propan-1-one
CID 129462915
2-(4-(1,1-difluoroethyl)piperidin-1-yl)-N-methylacetamide
CID 92130809
N-[(3R,6S)-1-acetyl-6-(trifluoromethyl)piperidin-3-yl]-2,2,2-trifluoroacetamide
CID 132323406
2-[3-(4,4-difluoropiperidin-1-yl)propyl-methylamino]-N-propan-2-ylacetamide
CID 132390947
N-(1-ethylpiperidin-3-yl)-2,2,2-trifluoroacetamide
CID 62726929
2,2,2-trifluoro-N-(2-piperidylethyl)acetamide
CID 1492594
2-(Methylamino)-1-piperidin-1-ylethanone
CID 7330590
2-(4-Fluoropiperidin-1-yl)acetamide
CID 18179867
2-(3-Fluoropiperidin-1-yl)acetamide
CID 18179970

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide?
The IUPAC name of 2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide (CID 121184616) is 2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide.
What is the SMILES notation for 2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide?
The canonical SMILES for 2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide is CNC(=O)CN1CCC(F)(F)CC1.
What is the InChIKey of 2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide?
The InChIKey is UDFKKHXSDLJARY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2N2O/c1-11-7(13)6-12-4-2-8(9,10)3-5-12/h2-6H2,1H3,(H,11,13).
What are the key properties of 2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide?
2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide has a molecular weight of 192.21 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-difluoropiperidin-1-yl)-N-methylacetamide is sourced from PubChem (CID 121184616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).