N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide

C20H23NO3 — CID 46579795

IUPACN-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1cccc(OC2CCCC2)c1
InChIInChI=1S/C20H23NO3/c1-15(23-17-9-3-2-4-10-17)20(22)21-16-8-7-13-19(14-16)24-18-11-5-6-12-18/h2-4,7-10,13-15,18H,5-6,11-12H2,1H3,(H,21,22)
InChIKeyPEUHTVORVWALNE-UHFFFAOYSA-N
MW325.41 g/mol
LogP4.41
Rot. Bonds6

About N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide

N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide (PubChem CID 46579795) has the molecular formula C20H23NO3 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide.

Molecular Properties

Compound NameN-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide
PubChem CID46579795
Molecular FormulaC20H23NO3
Molecular Weight325.41 g/mol
Exact Mass325.17
IUPAC NameN-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1cccc(OC2CCCC2)c1
InChIInChI=1S/C20H23NO3/c1-15(23-17-9-3-2-4-10-17)20(22)21-16-8-7-13-19(14-16)24-18-11-5-6-12-18/h2-4,7-10,13-15,18H,5-6,11-12H2,1H3,(H,21,22)
InChIKeyPEUHTVORVWALNE-UHFFFAOYSA-N
XLogP4.41
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide?
The IUPAC name of N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide (CID 46579795) is N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide.
What is the SMILES notation for N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide?
The canonical SMILES for N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide is CC(Oc1ccccc1)C(=O)Nc1cccc(OC2CCCC2)c1.
What is the InChIKey of N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide?
The InChIKey is PEUHTVORVWALNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO3/c1-15(23-17-9-3-2-4-10-17)20(22)21-16-8-7-13-19(14-16)24-18-11-5-6-12-18/h2-4,7-10,13-15,18H,5-6,11-12H2,1H3,(H,21,22).
What are the key properties of N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide?
N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide has a molecular weight of 325.41 g/mol, XLogP of 4.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentyloxyphenyl)-2-phenoxypropanamide is sourced from PubChem (CID 46579795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).