2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide

C14H17ClFNO3 — CID 103774298

IUPAC2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide
SMILESO=C(COc1ccc(F)cc1Cl)NC1CCCC1CO
InChIInChI=1S/C14H17ClFNO3/c15-11-6-10(16)4-5-13(11)20-8-14(19)17-12-3-1-2-9(12)7-18/h4-6,9,12,18H,1-3,7-8H2,(H,17,19)
InChIKeyVCRCECWPCYUSHI-UHFFFAOYSA-N
MW301.74 g/mol
LogP2.14
Rot. Bonds5

About 2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide

2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide (PubChem CID 103774298) has the molecular formula C14H17ClFNO3 and a molecular weight of 301.74 g/mol. Its IUPAC name is 2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide.

Molecular Properties

Compound Name2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide
PubChem CID103774298
Molecular FormulaC14H17ClFNO3
Molecular Weight301.74 g/mol
Exact Mass301.09
IUPAC Name2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide
SMILESO=C(COc1ccc(F)cc1Cl)NC1CCCC1CO
InChIInChI=1S/C14H17ClFNO3/c15-11-6-10(16)4-5-13(11)20-8-14(19)17-12-3-1-2-9(12)7-18/h4-6,9,12,18H,1-3,7-8H2,(H,17,19)
InChIKeyVCRCECWPCYUSHI-UHFFFAOYSA-N
XLogP2.14
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.74
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dichlorophenoxy)-N-[(1S,2R)-2-(methoxymethyl)cyclopentyl]acetamide
CID 133134780
N-[2-(aminomethyl)cyclohexyl]-2-(2,4-difluorophenoxy)acetamide
CID 119610188
2-(2-chloro-4-fluorophenoxy)-N-(3-methylpiperidin-4-yl)acetamide
CID 120557960
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-(2-chloro-4-fluorophenoxy)acetamide
CID 119455158
2-(2-chloro-4-fluorophenoxy)-N-(3-methylcyclopentyl)acetamide
CID 114550159
N-[2-(aminomethyl)cyclopentyl]-2-(2-chlorophenoxy)acetamide;hydrochloride
CID 119603021
2-(2-aminophenoxy)-N-[2-(hydroxymethyl)cyclohexyl]acetamide
CID 106358626
N-(1-benzylpiperidin-4-yl)-2-(2-chloro-4-fluorophenoxy)acetamide
CID 17250306
2-(2-chloro-4-fluorophenoxy)acetohydrazide
CID 3818760
3-chloro-4-[2-(cyclobutylamino)-2-oxoethoxy]benzoic acid
CID 146171644
2-(2-chloro-4-fluorophenoxy)-N-(2-methylpiperidin-4-yl)acetamide
CID 120602502
2-(2-chloro-4-fluorophenoxy)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
CID 114631346

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide?
The IUPAC name of 2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide (CID 103774298) is 2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide.
What is the SMILES notation for 2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide?
The canonical SMILES for 2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide is O=C(COc1ccc(F)cc1Cl)NC1CCCC1CO.
What is the InChIKey of 2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide?
The InChIKey is VCRCECWPCYUSHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClFNO3/c15-11-6-10(16)4-5-13(11)20-8-14(19)17-12-3-1-2-9(12)7-18/h4-6,9,12,18H,1-3,7-8H2,(H,17,19).
What are the key properties of 2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide?
2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide has a molecular weight of 301.74 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]acetamide is sourced from PubChem (CID 103774298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).