N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide

C21H24FNO3 — CID 70697209

IUPACN-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CN(C(=O)CF)c1ccccc1OC1CCCC1
InChIInChI=1S/C21H24FNO3/c1-25-19-12-6-2-8-16(19)15-23(21(24)14-22)18-11-5-7-13-20(18)26-17-9-3-4-10-17/h2,5-8,11-13,17H,3-4,9-10,14-15H2,1H3
InChIKeyGJOXPERCMDUMRY-UHFFFAOYSA-N
MW357.43 g/mol
LogP4.52
Rot. Bonds7

About N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide

N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide (PubChem CID 70697209) has the molecular formula C21H24FNO3 and a molecular weight of 357.43 g/mol. Its IUPAC name is N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound NameN-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide
PubChem CID70697209
Molecular FormulaC21H24FNO3
Molecular Weight357.43 g/mol
Exact Mass357.17
IUPAC NameN-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CN(C(=O)CF)c1ccccc1OC1CCCC1
InChIInChI=1S/C21H24FNO3/c1-25-19-12-6-2-8-16(19)15-23(21(24)14-22)18-11-5-7-13-20(18)26-17-9-3-4-10-17/h2,5-8,11-13,17H,3-4,9-10,14-15H2,1H3
InChIKeyGJOXPERCMDUMRY-UHFFFAOYSA-N
XLogP4.52
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide?
The IUPAC name of N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide (CID 70697209) is N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide?
The canonical SMILES for N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide is COc1ccccc1CN(C(=O)CF)c1ccccc1OC1CCCC1.
What is the InChIKey of N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide?
The InChIKey is GJOXPERCMDUMRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24FNO3/c1-25-19-12-6-2-8-16(19)15-23(21(24)14-22)18-11-5-7-13-20(18)26-17-9-3-4-10-17/h2,5-8,11-13,17H,3-4,9-10,14-15H2,1H3.
What are the key properties of N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide?
N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide has a molecular weight of 357.43 g/mol, XLogP of 4.52, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyloxyphenyl)-2-fluoro-N-[(2-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 70697209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).