4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide

C21H24N2O3 — CID 108548897

IUPAC4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide
SMILESCOc1ccc(C(=O)NC2CCN(C(=O)Cc3ccccc3)CC2)cc1
InChIInChI=1S/C21H24N2O3/c1-26-19-9-7-17(8-10-19)21(25)22-18-11-13-23(14-12-18)20(24)15-16-5-3-2-4-6-16/h2-10,18H,11-15H2,1H3,(H,22,25)
InChIKeyILSJHDUVCWESBC-UHFFFAOYSA-N
MW352.43 g/mol
LogP2.66
Rot. Bonds5

About 4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide

4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide (PubChem CID 108548897) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is 4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide
PubChem CID108548897
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide
SMILESCOc1ccc(C(=O)NC2CCN(C(=O)Cc3ccccc3)CC2)cc1
InChIInChI=1S/C21H24N2O3/c1-26-19-9-7-17(8-10-19)21(25)22-18-11-13-23(14-12-18)20(24)15-16-5-3-2-4-6-16/h2-10,18H,11-15H2,1H3,(H,22,25)
InChIKeyILSJHDUVCWESBC-UHFFFAOYSA-N
XLogP2.66
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-N-[1-(2-phenylacetyl)piperidin-4-yl]acetamide
CID 108549864
2-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]carbamoyl]benzoic acid
CID 113083190
N-benzyl-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
CID 24793478
N-(1-benzylpiperidin-4-yl)-4-methoxybenzamide
CID 799331
N-[1-(4-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551232
N-[2-[4-[[2-(4-methoxyphenyl)acetyl]amino]piperidin-1-yl]-2-oxoethyl]benzamide
CID 108549855
4-methoxy-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
CID 108548880
N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]benzamide
CID 33308755
N-[1-[2-(4-aminophenyl)acetyl]piperidin-4-yl]benzamide;hydrochloride
CID 91641898
N-[1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl]benzamide
CID 24575446
4-benzamido-N-[2-(4-methoxyphenyl)ethyl]piperidine-1-carboxamide
CID 127163757
N-[1-[2-(2-methoxyphenyl)acetyl]piperidin-4-yl]-4-phenylbenzamide
CID 52820081

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide?
The IUPAC name of 4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide (CID 108548897) is 4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide?
The canonical SMILES for 4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide is COc1ccc(C(=O)NC2CCN(C(=O)Cc3ccccc3)CC2)cc1.
What is the InChIKey of 4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide?
The InChIKey is ILSJHDUVCWESBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-26-19-9-7-17(8-10-19)21(25)22-18-11-13-23(14-12-18)20(24)15-16-5-3-2-4-6-16/h2-10,18H,11-15H2,1H3,(H,22,25).
What are the key properties of 4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide?
4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide has a molecular weight of 352.43 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[1-(2-phenylacetyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 108548897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).