2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide

C17H23FN2O2 — CID 32541358

IUPAC2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide
SMILESCC(C)C(=O)N1CCC(NC(=O)Cc2cccc(F)c2)CC1
InChIInChI=1S/C17H23FN2O2/c1-12(2)17(22)20-8-6-15(7-9-20)19-16(21)11-13-4-3-5-14(18)10-13/h3-5,10,12,15H,6-9,11H2,1-2H3,(H,19,21)
InChIKeyMMFVCOBZDFKQIR-UHFFFAOYSA-N
MW306.38 g/mol
LogP2.13
Rot. Bonds4

About 2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide

2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide (PubChem CID 32541358) has the molecular formula C17H23FN2O2 and a molecular weight of 306.38 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide
PubChem CID32541358
Molecular FormulaC17H23FN2O2
Molecular Weight306.38 g/mol
Exact Mass306.17
IUPAC Name2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide
SMILESCC(C)C(=O)N1CCC(NC(=O)Cc2cccc(F)c2)CC1
InChIInChI=1S/C17H23FN2O2/c1-12(2)17(22)20-8-6-15(7-9-20)19-16(21)11-13-4-3-5-14(18)10-13/h3-5,10,12,15H,6-9,11H2,1-2H3,(H,19,21)
InChIKeyMMFVCOBZDFKQIR-UHFFFAOYSA-N
XLogP2.13
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.38
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-fluorophenyl)-N-[1-(3-methylbutanoyl)piperidin-4-yl]acetamide
CID 51093724
1-[4-[(3-fluorophenyl)methylamino]piperidin-1-yl]-2-methylpropan-1-one
CID 43434840
N-[1-[2-(3-fluorophenyl)acetyl]piperidin-4-yl]propanamide
CID 110822825
N-[1-(3,3-dimethylbutanoyl)piperidin-4-yl]-2-(3-fluorophenyl)acetamide
CID 110822279
N-[1-[2-(3-fluorophenyl)acetyl]piperidin-4-yl]acetamide
CID 49349287
1-[(2R)-2-(3-fluorophenyl)-2-hydroxyethyl]-3-[1-(2-methylpropanoyl)piperidin-4-yl]urea
CID 52532707
2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide
CID 78786047
1-[4-[1-(3-fluorophenyl)ethylamino]piperidin-1-yl]-2-methylpropan-1-one
CID 43747833
3-(3-fluorophenyl)-N-[1-(3-methylbutanoyl)piperidin-4-yl]propanamide
CID 110819641
N-[2-(3-fluorophenyl)ethyl]-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 32796393
N-(4-chlorocyclohexyl)-2-(3-fluorophenyl)acetamide
CID 114296854
methyl 4-[[2-(3-fluorophenyl)acetyl]amino]cyclohexane-1-carboxylate
CID 115617162

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide (CID 32541358) is 2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide is CC(C)C(=O)N1CCC(NC(=O)Cc2cccc(F)c2)CC1.
What is the InChIKey of 2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide?
The InChIKey is MMFVCOBZDFKQIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O2/c1-12(2)17(22)20-8-6-15(7-9-20)19-16(21)11-13-4-3-5-14(18)10-13/h3-5,10,12,15H,6-9,11H2,1-2H3,(H,19,21).
What are the key properties of 2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide?
2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide has a molecular weight of 306.38 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 32541358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).