2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide

C18H24FNO3 — CID 51088595

IUPAC2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide
SMILESO=C(COC1CCCC1)NC(c1ccc(F)cc1)C1CCCO1
InChIInChI=1S/C18H24FNO3/c19-14-9-7-13(8-10-14)18(16-6-3-11-22-16)20-17(21)12-23-15-4-1-2-5-15/h7-10,15-16,18H,1-6,11-12H2,(H,20,21)
InChIKeyJXNKBMAKAIBEEX-UHFFFAOYSA-N
MW321.39 g/mol
LogP3.12
Rot. Bonds6

About 2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide

2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide (PubChem CID 51088595) has the molecular formula C18H24FNO3 and a molecular weight of 321.39 g/mol. Its IUPAC name is 2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide
PubChem CID51088595
Molecular FormulaC18H24FNO3
Molecular Weight321.39 g/mol
Exact Mass321.17
IUPAC Name2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide
SMILESO=C(COC1CCCC1)NC(c1ccc(F)cc1)C1CCCO1
InChIInChI=1S/C18H24FNO3/c19-14-9-7-13(8-10-14)18(16-6-3-11-22-16)20-17(21)12-23-15-4-1-2-5-15/h7-10,15-16,18H,1-6,11-12H2,(H,20,21)
InChIKeyJXNKBMAKAIBEEX-UHFFFAOYSA-N
XLogP3.12
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.39
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide?
The IUPAC name of 2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide (CID 51088595) is 2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide.
What is the SMILES notation for 2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide?
The canonical SMILES for 2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide is O=C(COC1CCCC1)NC(c1ccc(F)cc1)C1CCCO1.
What is the InChIKey of 2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide?
The InChIKey is JXNKBMAKAIBEEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FNO3/c19-14-9-7-13(8-10-14)18(16-6-3-11-22-16)20-17(21)12-23-15-4-1-2-5-15/h7-10,15-16,18H,1-6,11-12H2,(H,20,21).
What are the key properties of 2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide?
2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide has a molecular weight of 321.39 g/mol, XLogP of 3.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-N-[(4-fluorophenyl)-(oxolan-2-yl)methyl]acetamide is sourced from PubChem (CID 51088595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).