2-cyclopentyl-N-(4-hexoxyphenyl)acetamide

C19H29NO2 — CID 54786135

IUPAC2-cyclopentyl-N-(4-hexoxyphenyl)acetamide
SMILESCCCCCCOc1ccc(NC(=O)CC2CCCC2)cc1
InChIInChI=1S/C19H29NO2/c1-2-3-4-7-14-22-18-12-10-17(11-13-18)20-19(21)15-16-8-5-6-9-16/h10-13,16H,2-9,14-15H2,1H3,(H,20,21)
InChIKeyQZWYQDRCQANPRV-UHFFFAOYSA-N
MW303.45 g/mol
LogP5.16
Rot. Bonds9

About 2-cyclopentyl-N-(4-hexoxyphenyl)acetamide

2-cyclopentyl-N-(4-hexoxyphenyl)acetamide (PubChem CID 54786135) has the molecular formula C19H29NO2 and a molecular weight of 303.45 g/mol. Its IUPAC name is 2-cyclopentyl-N-(4-hexoxyphenyl)acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-(4-hexoxyphenyl)acetamide
PubChem CID54786135
Molecular FormulaC19H29NO2
Molecular Weight303.45 g/mol
Exact Mass303.22
IUPAC Name2-cyclopentyl-N-(4-hexoxyphenyl)acetamide
SMILESCCCCCCOc1ccc(NC(=O)CC2CCCC2)cc1
InChIInChI=1S/C19H29NO2/c1-2-3-4-7-14-22-18-12-10-17(11-13-18)20-19(21)15-16-8-5-6-9-16/h10-13,16H,2-9,14-15H2,1H3,(H,20,21)
InChIKeyQZWYQDRCQANPRV-UHFFFAOYSA-N
XLogP5.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500303.45
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-butoxyphenyl)-2-cyclopentylacetamide
CID 54786143
2-cyclopentyl-N-[4-(2-hydroxyethoxy)phenyl]acetamide
CID 111116192
N-[4-(2-cyclohexylethoxy)phenyl]-4-heptoxybenzamide
CID 17137747
N-(4-decoxyphenyl)butanamide
CID 143303175
2-cyclopentyl-N-[4-(2-methylpropoxy)phenyl]acetamide
CID 54786144
2-(ethylamino)-N-(4-hexoxyphenyl)acetamide
CID 54821037
2-[(4-decoxyphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 56970029
N-(4-hydroxyphenyl)-N'-(4-octadecoxyphenyl)propanediamide
CID 18983779
3-cyclohexyl-N-(4-propoxyphenyl)propanamide
CID 110493363
N-[4-(cyanomethoxy)phenyl]-2-cyclopentylacetamide
CID 51177132
N-[4-(2-cyclohexylethoxy)phenyl]propanamide
CID 17137644
N-cyclohexyl-4-[[2-(4-hexoxyanilino)acetyl]amino]benzamide
CID 54820151

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-(4-hexoxyphenyl)acetamide?
The IUPAC name of 2-cyclopentyl-N-(4-hexoxyphenyl)acetamide (CID 54786135) is 2-cyclopentyl-N-(4-hexoxyphenyl)acetamide.
What is the SMILES notation for 2-cyclopentyl-N-(4-hexoxyphenyl)acetamide?
The canonical SMILES for 2-cyclopentyl-N-(4-hexoxyphenyl)acetamide is CCCCCCOc1ccc(NC(=O)CC2CCCC2)cc1.
What is the InChIKey of 2-cyclopentyl-N-(4-hexoxyphenyl)acetamide?
The InChIKey is QZWYQDRCQANPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO2/c1-2-3-4-7-14-22-18-12-10-17(11-13-18)20-19(21)15-16-8-5-6-9-16/h10-13,16H,2-9,14-15H2,1H3,(H,20,21).
What are the key properties of 2-cyclopentyl-N-(4-hexoxyphenyl)acetamide?
2-cyclopentyl-N-(4-hexoxyphenyl)acetamide has a molecular weight of 303.45 g/mol, XLogP of 5.16, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-(4-hexoxyphenyl)acetamide is sourced from PubChem (CID 54786135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).