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

C16H22FNO2 — CID 90622891

IUPAC2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide
SMILESCOC(CNC(=O)CC1CCCC1)c1cccc(F)c1
InChIInChI=1S/C16H22FNO2/c1-20-15(13-7-4-8-14(17)10-13)11-18-16(19)9-12-5-2-3-6-12/h4,7-8,10,12,15H,2-3,5-6,9,11H2,1H3,(H,18,19)
InChIKeySVRJIVLPZFTCIB-UHFFFAOYSA-N
MW279.35 g/mol
LogP3.21
Rot. Bonds6

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

2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide (PubChem CID 90622891) has the molecular formula C16H22FNO2 and a molecular weight of 279.35 g/mol. Its IUPAC name is 2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide
PubChem CID90622891
Molecular FormulaC16H22FNO2
Molecular Weight279.35 g/mol
Exact Mass279.16
IUPAC Name2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide
SMILESCOC(CNC(=O)CC1CCCC1)c1cccc(F)c1
InChIInChI=1S/C16H22FNO2/c1-20-15(13-7-4-8-14(17)10-13)11-18-16(19)9-12-5-2-3-6-12/h4,7-8,10,12,15H,2-3,5-6,9,11H2,1H3,(H,18,19)
InChIKeySVRJIVLPZFTCIB-UHFFFAOYSA-N
XLogP3.21
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide?
The IUPAC name of 2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide (CID 90622891) is 2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide.
What is the SMILES notation for 2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide?
The canonical SMILES for 2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide is COC(CNC(=O)CC1CCCC1)c1cccc(F)c1.
What is the InChIKey of 2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide?
The InChIKey is SVRJIVLPZFTCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO2/c1-20-15(13-7-4-8-14(17)10-13)11-18-16(19)9-12-5-2-3-6-12/h4,7-8,10,12,15H,2-3,5-6,9,11H2,1H3,(H,18,19).
What are the key properties of 2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide?
2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide has a molecular weight of 279.35 g/mol, XLogP of 3.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide is sourced from PubChem (CID 90622891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).