2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide

C14H18ClNO2 — CID 90888344

IUPAC2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide
SMILESCC1CCC(NC(=O)COc2ccc(Cl)cc2)C1
InChIInChI=1S/C14H18ClNO2/c1-10-2-5-12(8-10)16-14(17)9-18-13-6-3-11(15)4-7-13/h3-4,6-7,10,12H,2,5,8-9H2,1H3,(H,16,17)
InChIKeyNIOULXVZUODLDN-UHFFFAOYSA-N
MW267.76 g/mol
LogP3.02
Rot. Bonds4

About 2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide

2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide (PubChem CID 90888344) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide
PubChem CID90888344
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC Name2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide
SMILESCC1CCC(NC(=O)COc2ccc(Cl)cc2)C1
InChIInChI=1S/C14H18ClNO2/c1-10-2-5-12(8-10)16-14(17)9-18-13-6-3-11(15)4-7-13/h3-4,6-7,10,12H,2,5,8-9H2,1H3,(H,16,17)
InChIKeyNIOULXVZUODLDN-UHFFFAOYSA-N
XLogP3.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenoxy)-N-[3-[[2-(4-chlorophenoxy)acetyl]amino]cyclopentyl]acetamide
CID 177253885
N-[4-[[2-(4-chlorophenoxy)acetyl]amino]cyclohexyl]-2-(4-methoxyphenoxy)acetamide
CID 121260490
2-(4-chlorophenoxy)-N-cyclooctylacetamide
CID 875180
2-(4-aminophenoxy)-N-[(1R,3R)-3-methylcyclohexyl]acetamide
CID 28689734
N-[4-[[2-(4-chlorophenoxy)acetyl]amino]cyclohexyl]-2-(4-ethynylphenoxy)acetamide
CID 90446748
2-(4-chlorophenoxy)-N-[4-[[2-(3,5-difluorophenoxy)acetyl]amino]cyclohexyl]acetamide
CID 121260487
N-[(3aS,6aR)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-yl]-2-(4-chlorophenoxy)acetamide
CID 139517667
2-(2-chloro-4-fluorophenoxy)-N-(3-methylcyclopentyl)acetamide
CID 114550159
2-[4-(aminomethyl)phenoxy]-N-(4-methylcyclohexyl)acetamide
CID 16796047
2-[[2-[2-[2-(4-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide
CID 9053234
[2-[2-[2-(4-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethyl]-[2-(cyclopropylamino)-2-oxoethyl]-methylazanium
CID 9053233
4-[[2-(4-chlorophenoxy)acetyl]amino]piperidine-1-carboxylic acid
CID 68885629

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide (CID 90888344) is 2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide is CC1CCC(NC(=O)COc2ccc(Cl)cc2)C1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide?
The InChIKey is NIOULXVZUODLDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c1-10-2-5-12(8-10)16-14(17)9-18-13-6-3-11(15)4-7-13/h3-4,6-7,10,12H,2,5,8-9H2,1H3,(H,16,17).
What are the key properties of 2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide?
2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide has a molecular weight of 267.76 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-(3-methylcyclopentyl)acetamide is sourced from PubChem (CID 90888344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).