N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide

C15H20FNO2 — CID 115880485

IUPACN-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide
SMILESCC1(C)CCC(NC(=O)COc2ccccc2F)C1
InChIInChI=1S/C15H20FNO2/c1-15(2)8-7-11(9-15)17-14(18)10-19-13-6-4-3-5-12(13)16/h3-6,11H,7-10H2,1-2H3,(H,17,18)
InChIKeyXKUDGMTZYSGPGF-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.90
Rot. Bonds4

About N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide

N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide (PubChem CID 115880485) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide
PubChem CID115880485
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC NameN-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide
SMILESCC1(C)CCC(NC(=O)COc2ccccc2F)C1
InChIInChI=1S/C15H20FNO2/c1-15(2)8-7-11(9-15)17-14(18)10-19-13-6-4-3-5-12(13)16/h3-6,11H,7-10H2,1-2H3,(H,17,18)
InChIKeyXKUDGMTZYSGPGF-UHFFFAOYSA-N
XLogP2.90
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide?
The IUPAC name of N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide (CID 115880485) is N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide.
What is the SMILES notation for N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide?
The canonical SMILES for N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide is CC1(C)CCC(NC(=O)COc2ccccc2F)C1.
What is the InChIKey of N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide?
The InChIKey is XKUDGMTZYSGPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-15(2)8-7-11(9-15)17-14(18)10-19-13-6-4-3-5-12(13)16/h3-6,11H,7-10H2,1-2H3,(H,17,18).
What are the key properties of N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide?
N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide has a molecular weight of 265.33 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylcyclopentyl)-2-(2-fluorophenoxy)acetamide is sourced from PubChem (CID 115880485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).