4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide

C18H24N2O3 — CID 108558031

IUPAC4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide
SMILESCC(=O)CCC(=O)NC1CCN(C(=O)Cc2ccccc2)CC1
InChIInChI=1S/C18H24N2O3/c1-14(21)7-8-17(22)19-16-9-11-20(12-10-16)18(23)13-15-5-3-2-4-6-15/h2-6,16H,7-13H2,1H3,(H,19,22)
InChIKeyLOEDMKSBOHTCMP-UHFFFAOYSA-N
MW316.40 g/mol
LogP1.71
Rot. Bonds6

About 4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide

4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide (PubChem CID 108558031) has the molecular formula C18H24N2O3 and a molecular weight of 316.40 g/mol. Its IUPAC name is 4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide.

Molecular Properties

Compound Name4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide
PubChem CID108558031
Molecular FormulaC18H24N2O3
Molecular Weight316.40 g/mol
Exact Mass316.18
IUPAC Name4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide
SMILESCC(=O)CCC(=O)NC1CCN(C(=O)Cc2ccccc2)CC1
InChIInChI=1S/C18H24N2O3/c1-14(21)7-8-17(22)19-16-9-11-20(12-10-16)18(23)13-15-5-3-2-4-6-15/h2-6,16H,7-13H2,1H3,(H,19,22)
InChIKeyLOEDMKSBOHTCMP-UHFFFAOYSA-N
XLogP1.71
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-phenylacetyl)piperidin-4-yl]propanamide
CID 110820721
2-(4-methoxyphenyl)-N-[1-(2-phenylacetyl)piperidin-4-yl]acetamide
CID 108549864
2-chloro-N-[1-(2-phenylacetyl)piperidin-4-yl]propanamide
CID 108564353
N-[1-(4-phenoxybutanoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551285
methyl 4-[[1-[2-(4-methylphenyl)acetyl]piperidin-4-yl]amino]-4-oxobutanoate
CID 110822777
N-[1-(2-phenylacetyl)piperidin-4-yl]cyclohexanecarboxamide
CID 2817995
N-[1-(4-oxopentanoyl)piperidin-4-yl]-2-thiophen-2-ylacetamide
CID 108554283
N-[1-(2-bromobenzoyl)piperidin-4-yl]-4-oxopentanamide
CID 108558019
ethyl 4-oxo-4-[[1-(3-phenylpropanoyl)piperidin-4-yl]amino]butanoate
CID 108566087
N-[1-(2-phenylacetyl)piperidin-4-yl]-2-(2,3,6-trimethylphenoxy)acetamide
CID 108553233
N-[1-(3-chloropropanoyl)piperidin-4-yl]-3-phenylpropanamide
CID 108561867
4-oxo-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]pentanamide
CID 108558110

Frequently Asked Questions

What is the IUPAC name of 4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide?
The IUPAC name of 4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide (CID 108558031) is 4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide.
What is the SMILES notation for 4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide?
The canonical SMILES for 4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide is CC(=O)CCC(=O)NC1CCN(C(=O)Cc2ccccc2)CC1.
What is the InChIKey of 4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide?
The InChIKey is LOEDMKSBOHTCMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3/c1-14(21)7-8-17(22)19-16-9-11-20(12-10-16)18(23)13-15-5-3-2-4-6-15/h2-6,16H,7-13H2,1H3,(H,19,22).
What are the key properties of 4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide?
4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide has a molecular weight of 316.40 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-N-[1-(2-phenylacetyl)piperidin-4-yl]pentanamide is sourced from PubChem (CID 108558031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).