N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide

C9H14F2N2O2 — CID 103515094

IUPACN-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide
SMILESCC(=O)NC1CCCN(C(=O)C(F)F)C1
InChIInChI=1S/C9H14F2N2O2/c1-6(14)12-7-3-2-4-13(5-7)9(15)8(10)11/h7-8H,2-5H2,1H3,(H,12,14)
InChIKeyGELIZRDCWHLBGX-UHFFFAOYSA-N
MW220.22 g/mol
LogP0.38
Rot. Bonds2

About N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide

N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide (PubChem CID 103515094) has the molecular formula C9H14F2N2O2 and a molecular weight of 220.22 g/mol. Its IUPAC name is N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide
PubChem CID103515094
Molecular FormulaC9H14F2N2O2
Molecular Weight220.22 g/mol
Exact Mass220.10
IUPAC NameN-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide
SMILESCC(=O)NC1CCCN(C(=O)C(F)F)C1
InChIInChI=1S/C9H14F2N2O2/c1-6(14)12-7-3-2-4-13(5-7)9(15)8(10)11/h7-8H,2-5H2,1H3,(H,12,14)
InChIKeyGELIZRDCWHLBGX-UHFFFAOYSA-N
XLogP0.38
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.22
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3S)-1-[(2S)-2-aminopropanoyl]piperidin-3-yl]acetamide
CID 66567589
N-[1-(2-amino-3-methylbutanoyl)piperidin-3-yl]acetamide
CID 54872010
N-[1-[2-(aminomethyl)-3-methylbutanoyl]piperidin-3-yl]acetamide
CID 65227144
N-[1-[2-(methylamino)acetyl]piperidin-3-yl]acetamide
CID 60947690
N-[1-(6-amino-2-methylheptanoyl)piperidin-3-yl]acetamide
CID 65292227
N-[1-(2-amino-3-methoxypropanoyl)piperidin-3-yl]acetamide
CID 81083280
N-(1-prop-2-enoylpiperidin-3-yl)acetamide
CID 60949044
N-[1-(3-chloropropanoyl)piperidin-3-yl]acetamide
CID 60948683
N-[(3R)-1-[(2R)-2-(methanesulfonamido)-4-methylpentanoyl]piperidin-3-yl]acetamide
CID 97313843
N-[1-[2-(3-fluorophenoxy)propanoyl]piperidin-3-yl]acetamide
CID 87005926
trans-(1S,2S)-2-[(3R)-3-acetamidopiperidine-1-carbonyl]cyclopropane-1-carboxylic acid
CID 93378578
N-[1-[2-(3-methylbutan-2-ylsulfanyl)acetyl]piperidin-3-yl]acetamide
CID 71926391

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide?
The IUPAC name of N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide (CID 103515094) is N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide.
What is the SMILES notation for N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide?
The canonical SMILES for N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide is CC(=O)NC1CCCN(C(=O)C(F)F)C1.
What is the InChIKey of N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide?
The InChIKey is GELIZRDCWHLBGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F2N2O2/c1-6(14)12-7-3-2-4-13(5-7)9(15)8(10)11/h7-8H,2-5H2,1H3,(H,12,14).
What are the key properties of N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide?
N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide has a molecular weight of 220.22 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,2-difluoroacetyl)piperidin-3-yl]acetamide is sourced from PubChem (CID 103515094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).