N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide

C15H21FN2O2 — CID 23324865

IUPACN-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide
SMILESCC(=O)N(OCc1ccccc1F)C1CCNCC1C
InChIInChI=1S/C15H21FN2O2/c1-11-9-17-8-7-15(11)18(12(2)19)20-10-13-5-3-4-6-14(13)16/h3-6,11,15,17H,7-10H2,1-2H3
InChIKeyZRKFPBPPJNYXQA-UHFFFAOYSA-N
MW280.34 g/mol
LogP2.10
Rot. Bonds4

About N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide

N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide (PubChem CID 23324865) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide
PubChem CID23324865
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC NameN-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide
SMILESCC(=O)N(OCc1ccccc1F)C1CCNCC1C
InChIInChI=1S/C15H21FN2O2/c1-11-9-17-8-7-15(11)18(12(2)19)20-10-13-5-3-4-6-14(13)16/h3-6,11,15,17H,7-10H2,1-2H3
InChIKeyZRKFPBPPJNYXQA-UHFFFAOYSA-N
XLogP2.10
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide?
The IUPAC name of N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide (CID 23324865) is N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide?
The canonical SMILES for N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide is CC(=O)N(OCc1ccccc1F)C1CCNCC1C.
What is the InChIKey of N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide?
The InChIKey is ZRKFPBPPJNYXQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-11-9-17-8-7-15(11)18(12(2)19)20-10-13-5-3-4-6-14(13)16/h3-6,11,15,17H,7-10H2,1-2H3.
What are the key properties of N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide?
N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide has a molecular weight of 280.34 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methoxy]-N-(3-methylpiperidin-4-yl)acetamide is sourced from PubChem (CID 23324865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).