N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide

C16H23FN2O2 — CID 63877072

IUPACN-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide
SMILESCC(c1ccc(F)cc1)N(C)C(=O)COC1CCNCC1
InChIInChI=1S/C16H23FN2O2/c1-12(13-3-5-14(17)6-4-13)19(2)16(20)11-21-15-7-9-18-10-8-15/h3-6,12,15,18H,7-11H2,1-2H3
InChIKeyKLIQOKHSRCTCEV-UHFFFAOYSA-N
MW294.37 g/mol
LogP2.11
Rot. Bonds5

About N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide

N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide (PubChem CID 63877072) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide
PubChem CID63877072
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC NameN-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide
SMILESCC(c1ccc(F)cc1)N(C)C(=O)COC1CCNCC1
InChIInChI=1S/C16H23FN2O2/c1-12(13-3-5-14(17)6-4-13)19(2)16(20)11-21-15-7-9-18-10-8-15/h3-6,12,15,18H,7-11H2,1-2H3
InChIKeyKLIQOKHSRCTCEV-UHFFFAOYSA-N
XLogP2.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide?
The IUPAC name of N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide (CID 63877072) is N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide?
The canonical SMILES for N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide is CC(c1ccc(F)cc1)N(C)C(=O)COC1CCNCC1.
What is the InChIKey of N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide?
The InChIKey is KLIQOKHSRCTCEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-12(13-3-5-14(17)6-4-13)19(2)16(20)11-21-15-7-9-18-10-8-15/h3-6,12,15,18H,7-11H2,1-2H3.
What are the key properties of N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide?
N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide has a molecular weight of 294.37 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide is sourced from PubChem (CID 63877072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).