2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide

C18H26N2O2 — CID 38857062

IUPAC2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide
SMILESCC(=O)Nc1ccc(CC(=O)NCCCC2CCCC2)cc1
InChIInChI=1S/C18H26N2O2/c1-14(21)20-17-10-8-16(9-11-17)13-18(22)19-12-4-7-15-5-2-3-6-15/h8-11,15H,2-7,12-13H2,1H3,(H,19,22)(H,20,21)
InChIKeyXWWIZGKFPSYLRQ-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.27
Rot. Bonds7

About 2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide

2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide (PubChem CID 38857062) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is 2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide.

Molecular Properties

Compound Name2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide
PubChem CID38857062
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide
SMILESCC(=O)Nc1ccc(CC(=O)NCCCC2CCCC2)cc1
InChIInChI=1S/C18H26N2O2/c1-14(21)20-17-10-8-16(9-11-17)13-18(22)19-12-4-7-15-5-2-3-6-15/h8-11,15H,2-7,12-13H2,1H3,(H,19,22)(H,20,21)
InChIKeyXWWIZGKFPSYLRQ-UHFFFAOYSA-N
XLogP3.27
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(4-aminophenyl)-N-(3-cyclopentylpropyl)acetamide
CID 103630550
N-[4-[2-[[N-(3-cyclopentylpropyl)-N'-methylcarbamimidoyl]amino]ethyl]phenyl]acetamide;hydroiodide
CID 111947212
N-[4-(4-cyclobutylbutyl)phenyl]acetamide
CID 130280678
2-(4-acetamidophenyl)-N-(3-aminopropyl)acetamide
CID 108792677
2-(4-acetamidophenyl)-N-(2-hydroxyethyl)acetamide
CID 11287807
2-(4-acetamidophenyl)-N-[3-(dimethylamino)propyl]acetamide
CID 78804891
2-(4-acetamidophenyl)-N-(6-aminohexyl)acetamide
CID 108792623
2-[[2-[4-(4-cyclohexylbutanoylamino)phenyl]acetyl]amino]acetic acid
CID 119224601
2-(4-acetamidophenyl)-N-cyclopentyloxyacetamide
CID 83202703
2-(4-acetamidophenyl)-N-(3-phenylpropyl)acetamide
CID 27647223
2-[2-(aminomethyl)phenyl]-N-(3-cyclopentylpropyl)acetamide
CID 106011679
4-(chloromethyl)-N-(3-cyclopentylpropyl)benzamide
CID 106009628

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide?
The IUPAC name of 2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide (CID 38857062) is 2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide.
What is the SMILES notation for 2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide?
The canonical SMILES for 2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide is CC(=O)Nc1ccc(CC(=O)NCCCC2CCCC2)cc1.
What is the InChIKey of 2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide?
The InChIKey is XWWIZGKFPSYLRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-14(21)20-17-10-8-16(9-11-17)13-18(22)19-12-4-7-15-5-2-3-6-15/h8-11,15H,2-7,12-13H2,1H3,(H,19,22)(H,20,21).
What are the key properties of 2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide?
2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide has a molecular weight of 302.42 g/mol, XLogP of 3.27, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidophenyl)-N-(3-cyclopentylpropyl)acetamide is sourced from PubChem (CID 38857062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).