2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide

C21H23F2N3O2 — CID 58442844

IUPAC2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide
SMILESCC(=O)N1CCC(CC(=O)Nc2ncc(-c3cc(F)cc(F)c3)cc2C)CC1
InChIInChI=1S/C21H23F2N3O2/c1-13-7-17(16-9-18(22)11-19(23)10-16)12-24-21(13)25-20(28)8-15-3-5-26(6-4-15)14(2)27/h7,9-12,15H,3-6,8H2,1-2H3,(H,24,25,28)
InChIKeyMDAUKBHOPVSZQM-UHFFFAOYSA-N
MW387.43 g/mol
LogP3.92
Rot. Bonds4

About 2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide

2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide (PubChem CID 58442844) has the molecular formula C21H23F2N3O2 and a molecular weight of 387.43 g/mol. Its IUPAC name is 2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide
PubChem CID58442844
Molecular FormulaC21H23F2N3O2
Molecular Weight387.43 g/mol
Exact Mass387.18
IUPAC Name2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide
SMILESCC(=O)N1CCC(CC(=O)Nc2ncc(-c3cc(F)cc(F)c3)cc2C)CC1
InChIInChI=1S/C21H23F2N3O2/c1-13-7-17(16-9-18(22)11-19(23)10-16)12-24-21(13)25-20(28)8-15-3-5-26(6-4-15)14(2)27/h7,9-12,15H,3-6,8H2,1-2H3,(H,24,25,28)
InChIKeyMDAUKBHOPVSZQM-UHFFFAOYSA-N
XLogP3.92
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.43
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(3,5-difluorophenyl)-2-pyridinyl]-2-(1-propylsulfonylpiperidin-4-yl)acetamide
CID 58442893
2-(1-acetylpiperidin-4-yl)-N-[4-(3,4-difluorophenyl)phenyl]acetamide
CID 58442908
2-(1-acetylpiperidin-4-yl)-N-(4-phenyl-2-pyridinyl)acetamide
CID 58442951
N-[5-(3,5-difluorophenyl)-2-pyridinyl]-2-(1,1-dimethyl-3-oxo-6,7,8,8a-tetrahydro-5H-[1,3]oxazolo[3,4-a]pyridin-7-yl)acetamide
CID 67400246
2-(1-acetylpiperidin-4-yl)-N-(1-ethylpyrazol-4-yl)acetamide
CID 92631853
2-(azetidin-3-yl)-N-(5-bromo-3-methyl-2-pyridinyl)acetamide
CID 83170220
N-[4-[5-acetyl-2-(4-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-3-yl]-2-pyridinyl]-2-cyclopropylacetamide
CID 167130311
1-(1-acetylpiperidin-4-yl)-4-chloro-N-[3-methyl-5-[4-(trifluoromethoxy)phenyl]-2-pyridinyl]pyrazole-5-carboxamide
CID 171601470
1-[4-(3,5-difluoroanilino)piperidin-1-yl]ethanone
CID 43764958
N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-2-[1-(5-methyl-1H-pyrazole-4-carbonyl)piperidin-4-yl]acetamide
CID 175655803
2-(1-acetylpiperidin-4-yl)-1-(2-fluoro-4-methylphenyl)ethanone
CID 144525769
N-(5-bromo-3-methyl-2-pyridinyl)-2-pyrrolidin-1-ylacetamide
CID 67362705

Frequently Asked Questions

What is the IUPAC name of 2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide?
The IUPAC name of 2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide (CID 58442844) is 2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide.
What is the SMILES notation for 2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide?
The canonical SMILES for 2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide is CC(=O)N1CCC(CC(=O)Nc2ncc(-c3cc(F)cc(F)c3)cc2C)CC1.
What is the InChIKey of 2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide?
The InChIKey is MDAUKBHOPVSZQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23F2N3O2/c1-13-7-17(16-9-18(22)11-19(23)10-16)12-24-21(13)25-20(28)8-15-3-5-26(6-4-15)14(2)27/h7,9-12,15H,3-6,8H2,1-2H3,(H,24,25,28).
What are the key properties of 2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide?
2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide has a molecular weight of 387.43 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-acetylpiperidin-4-yl)-N-[5-(3,5-difluorophenyl)-3-methyl-2-pyridinyl]acetamide is sourced from PubChem (CID 58442844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).