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

C16H21FN2O2 — CID 110726946

IUPACN-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(C(=O)CCc2cccc(F)c2)CC1
InChIInChI=1S/C16H21FN2O2/c1-12(20)18-15-7-9-19(10-8-15)16(21)6-5-13-3-2-4-14(17)11-13/h2-4,11,15H,5-10H2,1H3,(H,18,20)
InChIKeyHQGCGLYCLHOHFF-UHFFFAOYSA-N
MW292.35 g/mol
LogP1.89
Rot. Bonds4

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

N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide (PubChem CID 110726946) has the molecular formula C16H21FN2O2 and a molecular weight of 292.35 g/mol. Its IUPAC name is N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide
PubChem CID110726946
Molecular FormulaC16H21FN2O2
Molecular Weight292.35 g/mol
Exact Mass292.16
IUPAC NameN-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(C(=O)CCc2cccc(F)c2)CC1
InChIInChI=1S/C16H21FN2O2/c1-12(20)18-15-7-9-19(10-8-15)16(21)6-5-13-3-2-4-14(17)11-13/h2-4,11,15H,5-10H2,1H3,(H,18,20)
InChIKeyHQGCGLYCLHOHFF-UHFFFAOYSA-N
XLogP1.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-[2-(3-fluorophenyl)acetyl]piperidin-4-yl]acetamide
CID 49349287
N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]-3,3-dimethylbutanamide
CID 110822684
3-(3-fluorophenyl)-N-[1-(3-methylbutanoyl)piperidin-4-yl]propanamide
CID 110819641
N-cyclopentyl-4-[3-(3-fluorophenyl)propanoyl]-1,4-diazepane-1-carboxamide
CID 110811802
ethyl [4-[[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]carbamoyl]phenyl] carbonate
CID 108930460
1-(4-cyclopropylpiperazin-1-yl)-3-(3-fluorophenyl)propan-1-one
CID 86853553
3-(3-fluorophenyl)-1-[4-[2-(3-fluorophenyl)acetyl]piperazin-1-yl]propan-1-one
CID 110670217
ethyl 1-[3-(3-fluorophenyl)propanoyl]piperidine-4-carboxylate
CID 110675452
N-[(3S,4R)-1-[3-(3-fluorophenyl)propanoyl]-4-propan-2-ylpyrrolidin-3-yl]acetamide
CID 70731741
N-[1-[2-(3-fluorophenyl)acetyl]piperidin-4-yl]propanamide
CID 110822825
N-[1-(3-fluorobenzoyl)piperidin-4-yl]acetamide
CID 49348900
N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]thiophene-2-sulfonamide
CID 33173044

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide?
The IUPAC name of N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide (CID 110726946) is N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide.
What is the SMILES notation for N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide?
The canonical SMILES for N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide is CC(=O)NC1CCN(C(=O)CCc2cccc(F)c2)CC1.
What is the InChIKey of N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide?
The InChIKey is HQGCGLYCLHOHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O2/c1-12(20)18-15-7-9-19(10-8-15)16(21)6-5-13-3-2-4-14(17)11-13/h2-4,11,15H,5-10H2,1H3,(H,18,20).
What are the key properties of N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide?
N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide has a molecular weight of 292.35 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 110726946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).