4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide

C22H26FN3O2 — CID 53145950

IUPAC4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide
SMILESCC(=O)Nc1ccc(C(=O)NC(C)c2ccc(F)cc2)c(N2CCCCC2)c1
InChIInChI=1S/C22H26FN3O2/c1-15(17-6-8-18(23)9-7-17)24-22(28)20-11-10-19(25-16(2)27)14-21(20)26-12-4-3-5-13-26/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,24,28)(H,25,27)
InChIKeyQDFJSDVRTMDILS-UHFFFAOYSA-N
MW383.47 g/mol
LogP4.27
Rot. Bonds5

About 4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide

4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide (PubChem CID 53145950) has the molecular formula C22H26FN3O2 and a molecular weight of 383.47 g/mol. Its IUPAC name is 4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide.

Molecular Properties

Compound Name4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide
PubChem CID53145950
Molecular FormulaC22H26FN3O2
Molecular Weight383.47 g/mol
Exact Mass383.20
IUPAC Name4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide
SMILESCC(=O)Nc1ccc(C(=O)NC(C)c2ccc(F)cc2)c(N2CCCCC2)c1
InChIInChI=1S/C22H26FN3O2/c1-15(17-6-8-18(23)9-7-17)24-22(28)20-11-10-19(25-16(2)27)14-21(20)26-12-4-3-5-13-26/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,24,28)(H,25,27)
InChIKeyQDFJSDVRTMDILS-UHFFFAOYSA-N
XLogP4.27
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.47
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-acetamido-2-piperidin-1-ylbenzamide
CID 69312911
N-[(1S)-1-(4-fluorophenyl)ethyl]-4-piperidin-1-ylbenzamide
CID 28636051
N-[4-(azepan-1-yl)-3-fluorophenyl]acetamide
CID 155741497
5-benzamido-N-[(1S)-1-phenylethyl]-2-pyrrolidin-1-ylbenzamide
CID 1063350
5-(2,2-dimethylpropanoylamino)-N-(1-phenylethyl)-2-piperidin-1-ylbenzamide
CID 4302250
5-[[(2S)-2-chloropropanoyl]amino]-N-[(1S)-1-phenylethyl]-2-piperidin-1-ylbenzamide
CID 1066160
5-[(2,6-dimethylphenyl)carbamoylamino]-N-(1-phenylethyl)-2-piperidin-1-ylbenzamide
CID 3965125
N-(4-amino-3-piperidin-1-ylphenyl)acetamide
CID 69310437
4-[1-[(5-bromo-2-piperidin-1-ylbenzoyl)amino]ethyl]benzoic acid
CID 70588447
2-(azepan-1-yl)-4-(cyclopropanecarbonylamino)-N-(1-pyridin-2-ylethyl)benzamide
CID 53200695
N-butan-2-yl-5-[[2-(4-fluorophenyl)acetyl]amino]-2-piperidin-1-ylbenzamide
CID 3646129
5-(3,3-dimethylbutanoylamino)-N-[(1S)-1-phenylethyl]-2-piperidin-1-ylbenzamide
CID 1066129

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide?
The IUPAC name of 4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide (CID 53145950) is 4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide.
What is the SMILES notation for 4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide?
The canonical SMILES for 4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide is CC(=O)Nc1ccc(C(=O)NC(C)c2ccc(F)cc2)c(N2CCCCC2)c1.
What is the InChIKey of 4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide?
The InChIKey is QDFJSDVRTMDILS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26FN3O2/c1-15(17-6-8-18(23)9-7-17)24-22(28)20-11-10-19(25-16(2)27)14-21(20)26-12-4-3-5-13-26/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,24,28)(H,25,27).
What are the key properties of 4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide?
4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide has a molecular weight of 383.47 g/mol, XLogP of 4.27, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-1-ylbenzamide is sourced from PubChem (CID 53145950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).