N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide

C21H25NO3 — CID 132651998

IUPACN-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide
SMILESCCC(Oc1ccccc1)C(=O)Nc1ccc(OC2CCCC2)cc1
InChIInChI=1S/C21H25NO3/c1-2-20(25-18-8-4-3-5-9-18)21(23)22-16-12-14-19(15-13-16)24-17-10-6-7-11-17/h3-5,8-9,12-15,17,20H,2,6-7,10-11H2,1H3,(H,22,23)
InChIKeyPKMQDAZUIZSPQF-UHFFFAOYSA-N
MW339.44 g/mol
LogP4.80
Rot. Bonds7

About N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide

N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide (PubChem CID 132651998) has the molecular formula C21H25NO3 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide.

Molecular Properties

Compound NameN-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide
PubChem CID132651998
Molecular FormulaC21H25NO3
Molecular Weight339.44 g/mol
Exact Mass339.18
IUPAC NameN-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide
SMILESCCC(Oc1ccccc1)C(=O)Nc1ccc(OC2CCCC2)cc1
InChIInChI=1S/C21H25NO3/c1-2-20(25-18-8-4-3-5-9-18)21(23)22-16-12-14-19(15-13-16)24-17-10-6-7-11-17/h3-5,8-9,12-15,17,20H,2,6-7,10-11H2,1H3,(H,22,23)
InChIKeyPKMQDAZUIZSPQF-UHFFFAOYSA-N
XLogP4.80
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-cyclopentyloxyphenyl)-2-(3,5-dimethylphenoxy)butanamide
CID 132655055
N-(4-cyclopentyloxyphenyl)-2-(2-methylphenoxy)butanamide
CID 132653358
(2S)-2-phenoxy-N-[4-(2-phenoxyethoxy)phenyl]butanamide
CID 9296848
(2R)-N-(4-iodophenyl)-2-phenoxybutanamide
CID 1369955
(2R)-2-phenoxy-N-(4-pyrrolidin-1-ylphenyl)butanamide
CID 41491672
2-(4-cyclopentyloxyanilino)-N-phenylpropanamide
CID 42950148
2-phenoxy-N-(4-phenylmethoxyphenyl)butanamide
CID 2944488
(2S,3S)-2-amino-N-(4-cyclopentyloxyphenyl)-3-methylpentanamide
CID 61178379
(2R)-2-phenoxy-N-(4-piperidin-1-ylphenyl)butanamide
CID 7409300
2-phenoxy-N-(4-phenyldiazenylphenyl)butanamide
CID 3643695
N-[4-(2-ethoxyethoxy)phenyl]-2-phenoxybutanamide
CID 17130611
2-phenoxy-N-[4-(2-phenylethoxy)phenyl]butanamide
CID 17066992

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide?
The IUPAC name of N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide (CID 132651998) is N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide.
What is the SMILES notation for N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide?
The canonical SMILES for N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide is CCC(Oc1ccccc1)C(=O)Nc1ccc(OC2CCCC2)cc1.
What is the InChIKey of N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide?
The InChIKey is PKMQDAZUIZSPQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO3/c1-2-20(25-18-8-4-3-5-9-18)21(23)22-16-12-14-19(15-13-16)24-17-10-6-7-11-17/h3-5,8-9,12-15,17,20H,2,6-7,10-11H2,1H3,(H,22,23).
What are the key properties of N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide?
N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide has a molecular weight of 339.44 g/mol, XLogP of 4.80, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopentyloxyphenyl)-2-phenoxybutanamide is sourced from PubChem (CID 132651998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).