N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide

C16H23FN2O — CID 82734161

IUPACN-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide
SMILESCCC1CCCNC1CNC(=O)Cc1ccc(F)cc1
InChIInChI=1S/C16H23FN2O/c1-2-13-4-3-9-18-15(13)11-19-16(20)10-12-5-7-14(17)8-6-12/h5-8,13,15,18H,2-4,9-11H2,1H3,(H,19,20)
InChIKeyOFEWZLVCJDXUKZ-UHFFFAOYSA-N
MW278.37 g/mol
LogP2.26
Rot. Bonds5

About N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide

N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide (PubChem CID 82734161) has the molecular formula C16H23FN2O and a molecular weight of 278.37 g/mol. Its IUPAC name is N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide
PubChem CID82734161
Molecular FormulaC16H23FN2O
Molecular Weight278.37 g/mol
Exact Mass278.18
IUPAC NameN-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide
SMILESCCC1CCCNC1CNC(=O)Cc1ccc(F)cc1
InChIInChI=1S/C16H23FN2O/c1-2-13-4-3-9-18-15(13)11-19-16(20)10-12-5-7-14(17)8-6-12/h5-8,13,15,18H,2-4,9-11H2,1H3,(H,19,20)
InChIKeyOFEWZLVCJDXUKZ-UHFFFAOYSA-N
XLogP2.26
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-ethylpiperidin-2-yl)methyl]-2-fluoro-6-hydroxybenzamide
CID 107014745
N-[(3-ethylpiperidin-2-yl)methyl]acetamide
CID 82734521
N-[(3-ethylpiperidin-2-yl)methyl]pentanamide
CID 82735090
1-[(3-ethylpiperidin-2-yl)methyl]-3-(3-fluorophenyl)urea
CID 82734312
2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide
CID 82732420
N-[(3-ethylpiperidin-2-yl)methyl]-3-fluoro-4-methoxybenzamide
CID 82732425
2-(3-fluorophenyl)-N-[(3-methylpiperidin-2-yl)methyl]acetamide
CID 63305010
N-(cyclobutylmethyl)-2-(4-fluorophenyl)acetamide
CID 94168873
N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide
CID 82732402
1-[(3-ethylpiperidin-2-yl)methyl]-3-(4-methylphenyl)urea
CID 82733939
N-[(3-ethylpiperidin-2-yl)methyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 103206941
trans-(1S,2R)-2-[[[2-(4-fluorophenyl)acetyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 108755751

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide (CID 82734161) is N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide is CCC1CCCNC1CNC(=O)Cc1ccc(F)cc1.
What is the InChIKey of N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide?
The InChIKey is OFEWZLVCJDXUKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O/c1-2-13-4-3-9-18-15(13)11-19-16(20)10-12-5-7-14(17)8-6-12/h5-8,13,15,18H,2-4,9-11H2,1H3,(H,19,20).
What are the key properties of N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide?
N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide has a molecular weight of 278.37 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 82734161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).