N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide

C19H25FN2O2 — CID 59434297

IUPACN-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide
SMILESCC(=O)N(c1ccc(F)cc1)C1CCN(C2CCC(=O)CC2)CC1
InChIInChI=1S/C19H25FN2O2/c1-14(23)22(17-4-2-15(20)3-5-17)18-10-12-21(13-11-18)16-6-8-19(24)9-7-16/h2-5,16,18H,6-13H2,1H3
InChIKeyYKAOGNGVMNKLME-UHFFFAOYSA-N
MW332.42 g/mol
LogP3.15
Rot. Bonds3

About N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide

N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide (PubChem CID 59434297) has the molecular formula C19H25FN2O2 and a molecular weight of 332.42 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide
PubChem CID59434297
Molecular FormulaC19H25FN2O2
Molecular Weight332.42 g/mol
Exact Mass332.19
IUPAC NameN-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide
SMILESCC(=O)N(c1ccc(F)cc1)C1CCN(C2CCC(=O)CC2)CC1
InChIInChI=1S/C19H25FN2O2/c1-14(23)22(17-4-2-15(20)3-5-17)18-10-12-21(13-11-18)16-6-8-19(24)9-7-16/h2-5,16,18H,6-13H2,1H3
InChIKeyYKAOGNGVMNKLME-UHFFFAOYSA-N
XLogP3.15
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.42
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide?
The IUPAC name of N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide (CID 59434297) is N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide is CC(=O)N(c1ccc(F)cc1)C1CCN(C2CCC(=O)CC2)CC1.
What is the InChIKey of N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide?
The InChIKey is YKAOGNGVMNKLME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN2O2/c1-14(23)22(17-4-2-15(20)3-5-17)18-10-12-21(13-11-18)16-6-8-19(24)9-7-16/h2-5,16,18H,6-13H2,1H3.
What are the key properties of N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide?
N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide has a molecular weight of 332.42 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N-[1-(4-oxocyclohexyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 59434297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).