N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide

C21H24N2O3 — CID 108551244

IUPACN-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide
SMILESCOc1cccc(C(=O)N2CCC(NC(=O)Cc3ccccc3)CC2)c1
InChIInChI=1S/C21H24N2O3/c1-26-19-9-5-8-17(15-19)21(25)23-12-10-18(11-13-23)22-20(24)14-16-6-3-2-4-7-16/h2-9,15,18H,10-14H2,1H3,(H,22,24)
InChIKeyYRIDCCYAFWJJFN-UHFFFAOYSA-N
MW352.43 g/mol
LogP2.66
Rot. Bonds5

About N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide

N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide (PubChem CID 108551244) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide
PubChem CID108551244
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC NameN-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide
SMILESCOc1cccc(C(=O)N2CCC(NC(=O)Cc3ccccc3)CC2)c1
InChIInChI=1S/C21H24N2O3/c1-26-19-9-5-8-17(15-19)21(25)23-12-10-18(11-13-23)22-20(24)14-16-6-3-2-4-7-16/h2-9,15,18H,10-14H2,1H3,(H,22,24)
InChIKeyYRIDCCYAFWJJFN-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

N-[1-(4-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551232
methyl 4-[[1-(3-methoxybenzoyl)piperidin-4-yl]amino]-4-oxobutanoate
CID 110820541
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551288
N-[1-(3-methoxybenzoyl)piperidin-4-yl]naphthalene-1-carboxamide
CID 108554007
2-methoxy-N-[1-(3-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108549181
3-hydroxy-N-[1-(3-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108558264
N-cyclooctyl-2-[4-(3-methoxybenzoyl)piperazin-1-yl]acetamide
CID 35227706
N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-sulfanylbenzamide
CID 108554674
prop-2-enyl N-[1-(3-methoxybenzoyl)piperidin-4-yl]carbamate
CID 108564007
2-chloroethyl N-[1-(3-methoxybenzoyl)piperidin-4-yl]carbamate
CID 108564006
2-(4-methoxyphenyl)-N-[1-(2-phenylacetyl)piperidin-4-yl]acetamide
CID 108549864
N-[1-(3,4-dimethylbenzoyl)piperidin-4-yl]-2-(4-methoxyphenyl)acetamide
CID 108549926

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide?
The IUPAC name of N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide (CID 108551244) is N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide.
What is the SMILES notation for N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide?
The canonical SMILES for N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide is COc1cccc(C(=O)N2CCC(NC(=O)Cc3ccccc3)CC2)c1.
What is the InChIKey of N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide?
The InChIKey is YRIDCCYAFWJJFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-26-19-9-5-8-17(15-19)21(25)23-12-10-18(11-13-23)22-20(24)14-16-6-3-2-4-7-16/h2-9,15,18H,10-14H2,1H3,(H,22,24).
What are the key properties of N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide?
N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide 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 N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide is sourced from PubChem (CID 108551244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).