2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide

C14H17F2NO3 — CID 62519487

IUPAC2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
SMILESO=C(COc1ccc(F)cc1F)NC1(CO)CCCC1
InChIInChI=1S/C14H17F2NO3/c15-10-3-4-12(11(16)7-10)20-8-13(19)17-14(9-18)5-1-2-6-14/h3-4,7,18H,1-2,5-6,8-9H2,(H,17,19)
InChIKeyXJRZKJITYKMBHI-UHFFFAOYSA-N
MW285.29 g/mol
LogP1.76
Rot. Bonds5

About 2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide

2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide (PubChem CID 62519487) has the molecular formula C14H17F2NO3 and a molecular weight of 285.29 g/mol. Its IUPAC name is 2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide.

Molecular Properties

Compound Name2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
PubChem CID62519487
Molecular FormulaC14H17F2NO3
Molecular Weight285.29 g/mol
Exact Mass285.12
IUPAC Name2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
SMILESO=C(COc1ccc(F)cc1F)NC1(CO)CCCC1
InChIInChI=1S/C14H17F2NO3/c15-10-3-4-12(11(16)7-10)20-8-13(19)17-14(9-18)5-1-2-6-14/h3-4,7,18H,1-2,5-6,8-9H2,(H,17,19)
InChIKeyXJRZKJITYKMBHI-UHFFFAOYSA-N
XLogP1.76
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.29
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-difluorophenoxy)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]acetamide
CID 115362465
2-(2,4-dichlorophenoxy)-N-[1-(hydroxymethyl)cyclohexyl]acetamide
CID 62522356
N-[1-(aminomethyl)cyclopentyl]-2-(2-chloro-4-fluorophenoxy)acetamide
CID 119564877
2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
CID 103954074
2-[1-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]cyclobutyl]acetic acid
CID 79844426
2-(4-bromo-2-chlorophenoxy)-N-[1-(hydroxymethyl)cyclohexyl]acetamide
CID 62520939
(2R)-2-[[2-(2,4-difluorophenoxy)acetyl]amino]-3-hydroxypropanoic acid
CID 80749171
N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide
CID 115878022
2-(2,4-difluorophenoxy)-N'-methylacetohydrazide
CID 116820700
2-(2,4-difluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 580280
3-[[2-(2,4-difluorophenoxy)acetyl]amino]propanoic acid
CID 43170635
3-(2-fluorophenoxy)-N-[1-(hydroxymethyl)cyclobutyl]propanamide
CID 115878515

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide?
The IUPAC name of 2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide (CID 62519487) is 2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide.
What is the SMILES notation for 2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide?
The canonical SMILES for 2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide is O=C(COc1ccc(F)cc1F)NC1(CO)CCCC1.
What is the InChIKey of 2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide?
The InChIKey is XJRZKJITYKMBHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F2NO3/c15-10-3-4-12(11(16)7-10)20-8-13(19)17-14(9-18)5-1-2-6-14/h3-4,7,18H,1-2,5-6,8-9H2,(H,17,19).
What are the key properties of 2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide?
2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide has a molecular weight of 285.29 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide is sourced from PubChem (CID 62519487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).