N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide

C21H23NO3 — CID 164544675

IUPACN-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide
SMILESCC(=O)N(Cc1ccccc1)C1CC(=O)CC1OCc1ccccc1
InChIInChI=1S/C21H23NO3/c1-16(23)22(14-17-8-4-2-5-9-17)20-12-19(24)13-21(20)25-15-18-10-6-3-7-11-18/h2-11,20-21H,12-15H2,1H3
InChIKeyYLKJLXBTKNIXGY-UHFFFAOYSA-N
MW337.42 g/mol
LogP3.35
Rot. Bonds6

About N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide

N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide (PubChem CID 164544675) has the molecular formula C21H23NO3 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide.

Molecular Properties

Compound NameN-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide
PubChem CID164544675
Molecular FormulaC21H23NO3
Molecular Weight337.42 g/mol
Exact Mass337.17
IUPAC NameN-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide
SMILESCC(=O)N(Cc1ccccc1)C1CC(=O)CC1OCc1ccccc1
InChIInChI=1S/C21H23NO3/c1-16(23)22(14-17-8-4-2-5-9-17)20-12-19(24)13-21(20)25-15-18-10-6-3-7-11-18/h2-11,20-21H,12-15H2,1H3
InChIKeyYLKJLXBTKNIXGY-UHFFFAOYSA-N
XLogP3.35
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-(2,5-dioxo-1-phenylpyrrolidin-3-yl)acetamide
CID 3710802
(5S,6R)-6-methyl-5-phenylmethoxypiperidin-2-one
CID 44550895
N-benzyl-N-[(3R,4R,5S,6R)-2,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-yl]acetamide
CID 122386137
N-benzyl-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]acetamide
CID 23915049
benzyl N-benzyl-N-[(1R,2R,3R,4S)-5-oxo-2,3,4-tris(phenylmethoxy)cycloheptyl]carbamate
CID 13006318
trans-dimethyl (4S,5S)-4,5-bis(phenylmethoxy)cyclohexane-1,2-dicarboxylate
CID 11004179
(3-oxocyclobutyl) N-benzyl-N-methylcarbamate
CID 176797150
2-[carboxymethyl-[(2S)-2-phenylmethoxycyclopentyl]amino]acetic acid
CID 132839013
benzyl-[(3S,4R)-3-methoxypiperidin-4-yl]carbamic acid
CID 168862112
(2-phenylmethoxycyclopentyl)oxymethylbenzene
CID 14085268
N-[(2S,3S)-1-acetyl-2-formylpyrrolidin-3-yl]-N-benzylacetamide
CID 11000713
[(1S,2S)-2-aminocyclohexyl]-benzylcarbamic acid
CID 91447786

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide?
The IUPAC name of N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide (CID 164544675) is N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide.
What is the SMILES notation for N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide?
The canonical SMILES for N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide is CC(=O)N(Cc1ccccc1)C1CC(=O)CC1OCc1ccccc1.
What is the InChIKey of N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide?
The InChIKey is YLKJLXBTKNIXGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NO3/c1-16(23)22(14-17-8-4-2-5-9-17)20-12-19(24)13-21(20)25-15-18-10-6-3-7-11-18/h2-11,20-21H,12-15H2,1H3.
What are the key properties of N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide?
N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide has a molecular weight of 337.42 g/mol, XLogP of 3.35, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(4-oxo-2-phenylmethoxycyclopentyl)acetamide is sourced from PubChem (CID 164544675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).