N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide

C16H22FNO2 — CID 55572986

IUPACN-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide
SMILESO=C(COc1cccc(F)c1)NCCCC1CCCC1
InChIInChI=1S/C16H22FNO2/c17-14-8-3-9-15(11-14)20-12-16(19)18-10-4-7-13-5-1-2-6-13/h3,8-9,11,13H,1-2,4-7,10,12H2,(H,18,19)
InChIKeyQGVZKJQRMLCIGR-UHFFFAOYSA-N
MW279.35 g/mol
LogP3.29
Rot. Bonds7

About N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide

N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide (PubChem CID 55572986) has the molecular formula C16H22FNO2 and a molecular weight of 279.35 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide
PubChem CID55572986
Molecular FormulaC16H22FNO2
Molecular Weight279.35 g/mol
Exact Mass279.16
IUPAC NameN-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide
SMILESO=C(COc1cccc(F)c1)NCCCC1CCCC1
InChIInChI=1S/C16H22FNO2/c17-14-8-3-9-15(11-14)20-12-16(19)18-10-4-7-13-5-1-2-6-13/h3,8-9,11,13H,1-2,4-7,10,12H2,(H,18,19)
InChIKeyQGVZKJQRMLCIGR-UHFFFAOYSA-N
XLogP3.29
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(3-fluorophenoxy)-N-pentylacetamide
CID 110756252
[2-(cyclohexylmethylamino)-2-oxoethyl] 2-(3-fluorophenoxy)acetate
CID 2382552
5-[[2-(3-fluorophenoxy)acetyl]amino]pentanoic acid
CID 62032120
2-(3-fluorophenoxy)-N-(3-methoxypropyl)acetamide
CID 60626010
2-(3-fluorophenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide
CID 106121345
2-(3-fluorophenoxy)-N-[(3-hydroxycyclopentyl)methyl]acetamide
CID 103280490
2-(3-fluorophenoxy)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]acetamide
CID 110719295
N-[2-(3,4-difluorophenyl)ethyl]-2-(3-fluorophenoxy)acetamide
CID 110788271
2-(3-fluorophenoxy)-N-[2-(2-oxopiperidin-1-yl)ethyl]acetamide
CID 110722805
2-(3-fluorophenoxy)-N-(3-imidazol-1-ylpropyl)acetamide
CID 47101279
2-(3-fluorophenoxy)-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]acetamide
CID 34999063
2-(3-fluorophenoxy)-N-prop-2-ynylacetamide
CID 9008020

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide?
The IUPAC name of N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide (CID 55572986) is N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide.
What is the SMILES notation for N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide?
The canonical SMILES for N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide is O=C(COc1cccc(F)c1)NCCCC1CCCC1.
What is the InChIKey of N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide?
The InChIKey is QGVZKJQRMLCIGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO2/c17-14-8-3-9-15(11-14)20-12-16(19)18-10-4-7-13-5-1-2-6-13/h3,8-9,11,13H,1-2,4-7,10,12H2,(H,18,19).
What are the key properties of N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide?
N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide has a molecular weight of 279.35 g/mol, XLogP of 3.29, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylpropyl)-2-(3-fluorophenoxy)acetamide is sourced from PubChem (CID 55572986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).