N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide

C16H20F4N2O2 — CID 56783035

IUPACN-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide
SMILESO=C(Cc1cccc(OC(F)F)c1)NC1CCN(CC(F)F)CC1
InChIInChI=1S/C16H20F4N2O2/c17-14(18)10-22-6-4-12(5-7-22)21-15(23)9-11-2-1-3-13(8-11)24-16(19)20/h1-3,8,12,14,16H,4-7,9-10H2,(H,21,23)
InChIKeyNBHAJMISZHOHIQ-UHFFFAOYSA-N
MW348.34 g/mol
LogP2.68
Rot. Bonds7

About N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide

N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide (PubChem CID 56783035) has the molecular formula C16H20F4N2O2 and a molecular weight of 348.34 g/mol. Its IUPAC name is N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound NameN-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide
PubChem CID56783035
Molecular FormulaC16H20F4N2O2
Molecular Weight348.34 g/mol
Exact Mass348.15
IUPAC NameN-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide
SMILESO=C(Cc1cccc(OC(F)F)c1)NC1CCN(CC(F)F)CC1
InChIInChI=1S/C16H20F4N2O2/c17-14(18)10-22-6-4-12(5-7-22)21-15(23)9-11-2-1-3-13(8-11)24-16(19)20/h1-3,8,12,14,16H,4-7,9-10H2,(H,21,23)
InChIKeyNBHAJMISZHOHIQ-UHFFFAOYSA-N
XLogP2.68
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.34
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(hydroxymethyl)phenoxy]-N-[1-(2-methylpropyl)piperidin-4-yl]propanamide
CID 109388973
N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide
CID 25205437
2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide
CID 32541358
4-[[2-(3-propan-2-yloxyphenyl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 119229628
1-[1-(2-methylpropyl)piperidin-4-yl]-3-[(3-propan-2-yloxyphenyl)methyl]urea
CID 51122734
N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-(2,4,5-trichlorophenoxy)acetamide
CID 49074675
N-[1-[2-(3-fluorophenyl)acetyl]piperidin-4-yl]propanamide
CID 110822825
benzyl 4-[3-(difluoromethoxy)anilino]piperidine-1-carboxylate
CID 114280142
N-[1-(3,3-dimethylbutanoyl)piperidin-4-yl]-2-(3-methoxyphenyl)acetamide
CID 110822281
1-[1-[[3-(difluoromethoxy)phenyl]methyl]piperidin-4-yl]ethanol
CID 111113680
2-(3-fluorophenyl)-N-[1-(3-methylbutanoyl)piperidin-4-yl]acetamide
CID 51093724
(2R)-2-(2,3-dichlorophenoxy)-N-[1-(2,2-difluoroethyl)piperidin-4-yl]propanamide
CID 52534478

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide?
The IUPAC name of N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide (CID 56783035) is N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide.
What is the SMILES notation for N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide?
The canonical SMILES for N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide is O=C(Cc1cccc(OC(F)F)c1)NC1CCN(CC(F)F)CC1.
What is the InChIKey of N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide?
The InChIKey is NBHAJMISZHOHIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20F4N2O2/c17-14(18)10-22-6-4-12(5-7-22)21-15(23)9-11-2-1-3-13(8-11)24-16(19)20/h1-3,8,12,14,16H,4-7,9-10H2,(H,21,23).
What are the key properties of N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide?
N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide has a molecular weight of 348.34 g/mol, XLogP of 2.68, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,2-difluoroethyl)piperidin-4-yl]-2-[3-(difluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 56783035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).