N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide

C9H16F2N2O — CID 59854577

IUPACN-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide
SMILESCC(=O)NCCN1CCC(F)(F)CC1
InChIInChI=1S/C9H16F2N2O/c1-8(14)12-4-7-13-5-2-9(10,11)3-6-13/h2-7H2,1H3,(H,12,14)
InChIKeyHBJWHAUBCVMZSF-UHFFFAOYSA-N
MW206.24 g/mol
LogP0.85
Rot. Bonds3

About N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide

N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide (PubChem CID 59854577) has the molecular formula C9H16F2N2O and a molecular weight of 206.24 g/mol. Its IUPAC name is N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide
PubChem CID59854577
Molecular FormulaC9H16F2N2O
Molecular Weight206.24 g/mol
Exact Mass206.12
IUPAC NameN-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide
SMILESCC(=O)NCCN1CCC(F)(F)CC1
InChIInChI=1S/C9H16F2N2O/c1-8(14)12-4-7-13-5-2-9(10,11)3-6-13/h2-7H2,1H3,(H,12,14)
InChIKeyHBJWHAUBCVMZSF-UHFFFAOYSA-N
XLogP0.85
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2,3,3,4,4,4-Heptafluoro-1-(piperazin-1-yl)butan-1-one
CID 21801001
3,3,3-Trifluoro-1-(piperazin-1-yl)propan-1-one
CID 16777605
N-[2,2,3,3,4,4,5,5-octafluoro-1-(1-piperidinyl)pentyl]acetamide
CID 2852094
1-Piperidineacetamide, N-hexyl-
CID 3063350
2,2,2-trifluoro-N-(4-methylpiperidin-3-yl)acetamide
CID 122702900
1-[(3R)-3-Aminopiperidin-1-yl]-4,4,4-trifluorobutan-1-one
CID 102978512
N-cyclopentyl-2-[2,2-dimethyl-4-(2,2,2-trifluoroethyl)piperazin-1-yl]acetamide
CID 84598921
Acetamide, 2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)-
CID 6421687
2,2,2-Trifluoro-N-[2-(piperazin-1-yl)ethyl]acetamide
CID 20431442
N-(1-ethylpiperidin-4-yl)-2,2,2-trifluoroacetamide
CID 62732802
N-[1-(2-fluoroethyl)piperidin-4-yl]acetamide
CID 130652776
2-methyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]propanamide
CID 153399082

Frequently Asked Questions

What is the IUPAC name of N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide?
The IUPAC name of N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide (CID 59854577) is N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide is CC(=O)NCCN1CCC(F)(F)CC1.
What is the InChIKey of N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide?
The InChIKey is HBJWHAUBCVMZSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F2N2O/c1-8(14)12-4-7-13-5-2-9(10,11)3-6-13/h2-7H2,1H3,(H,12,14).
What are the key properties of N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide?
N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide has a molecular weight of 206.24 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4,4-difluoropiperidin-1-yl)ethyl]acetamide is sourced from PubChem (CID 59854577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).