3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide

C17H24FNO2 — CID 90622900

IUPAC3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide
SMILESCOC(CNC(=O)CCC1CCCC1)c1cccc(F)c1
InChIInChI=1S/C17H24FNO2/c1-21-16(14-7-4-8-15(18)11-14)12-19-17(20)10-9-13-5-2-3-6-13/h4,7-8,11,13,16H,2-3,5-6,9-10,12H2,1H3,(H,19,20)
InChIKeyHKGHEGXLPFWREA-UHFFFAOYSA-N
MW293.38 g/mol
LogP3.60
Rot. Bonds7

About 3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide

3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide (PubChem CID 90622900) has the molecular formula C17H24FNO2 and a molecular weight of 293.38 g/mol. Its IUPAC name is 3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide
PubChem CID90622900
Molecular FormulaC17H24FNO2
Molecular Weight293.38 g/mol
Exact Mass293.18
IUPAC Name3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide
SMILESCOC(CNC(=O)CCC1CCCC1)c1cccc(F)c1
InChIInChI=1S/C17H24FNO2/c1-21-16(14-7-4-8-15(18)11-14)12-19-17(20)10-9-13-5-2-3-6-13/h4,7-8,11,13,16H,2-3,5-6,9-10,12H2,1H3,(H,19,20)
InChIKeyHKGHEGXLPFWREA-UHFFFAOYSA-N
XLogP3.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.38
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide (CID 90622900) is 3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide is COC(CNC(=O)CCC1CCCC1)c1cccc(F)c1.
What is the InChIKey of 3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide?
The InChIKey is HKGHEGXLPFWREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24FNO2/c1-21-16(14-7-4-8-15(18)11-14)12-19-17(20)10-9-13-5-2-3-6-13/h4,7-8,11,13,16H,2-3,5-6,9-10,12H2,1H3,(H,19,20).
What are the key properties of 3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide?
3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide has a molecular weight of 293.38 g/mol, XLogP of 3.60, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]propanamide is sourced from PubChem (CID 90622900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).