N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide

C20H20F2N2O2 — CID 108560102

IUPACN-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NC1CCN(C(=O)c2ccc(F)cc2F)CC1
InChIInChI=1S/C20H20F2N2O2/c21-15-6-7-17(18(22)13-15)20(26)24-10-8-16(9-11-24)23-19(25)12-14-4-2-1-3-5-14/h1-7,13,16H,8-12H2,(H,23,25)
InChIKeyUAXBBMIJNOLNDZ-UHFFFAOYSA-N
MW358.39 g/mol
LogP2.93
Rot. Bonds4

About N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide

N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide (PubChem CID 108560102) has the molecular formula C20H20F2N2O2 and a molecular weight of 358.39 g/mol. Its IUPAC name is N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide
PubChem CID108560102
Molecular FormulaC20H20F2N2O2
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC NameN-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NC1CCN(C(=O)c2ccc(F)cc2F)CC1
InChIInChI=1S/C20H20F2N2O2/c21-15-6-7-17(18(22)13-15)20(26)24-10-8-16(9-11-24)23-19(25)12-14-4-2-1-3-5-14/h1-7,13,16H,8-12H2,(H,23,25)
InChIKeyUAXBBMIJNOLNDZ-UHFFFAOYSA-N
XLogP2.93
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-(4-fluorophenyl)acetamide
CID 108559484
N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]propanamide
CID 108562134
N-[2-[[1-(2,4-difluorobenzoyl)piperidin-4-yl]amino]-2-oxoethyl]benzamide
CID 108559772
N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-3-methoxypropanamide
CID 108562171
N-[1-(2-chlorobenzoyl)piperidin-4-yl]-2-(4-fluorophenyl)acetamide
CID 108549660
N-[1-(2-bromobenzoyl)piperidin-4-yl]-2-(4-fluorophenyl)acetamide
CID 108549654
N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108562910
3-chloro-N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]benzamide
CID 108559879
1-(2,4-difluorobenzoyl)-N-(4-phenylbutyl)piperidine-4-carboxamide
CID 24596971
2-(4-chlorophenyl)-N-[1-(2,3,4-trifluorobenzoyl)piperidin-4-yl]acetamide
CID 108566655
N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-4-pyrrol-1-ylbenzamide
CID 108561657
1-[4-(2,4-difluorobenzoyl)piperazin-1-yl]-3-phenylpropan-1-one
CID 48866857

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide?
The IUPAC name of N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide (CID 108560102) is N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide.
What is the SMILES notation for N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide?
The canonical SMILES for N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide is O=C(Cc1ccccc1)NC1CCN(C(=O)c2ccc(F)cc2F)CC1.
What is the InChIKey of N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide?
The InChIKey is UAXBBMIJNOLNDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F2N2O2/c21-15-6-7-17(18(22)13-15)20(26)24-10-8-16(9-11-24)23-19(25)12-14-4-2-1-3-5-14/h1-7,13,16H,8-12H2,(H,23,25).
What are the key properties of N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide?
N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide has a molecular weight of 358.39 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-2-phenylacetamide is sourced from PubChem (CID 108560102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).