N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide

C16H24FN3O — CID 63855022

IUPACN-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide
SMILESCNC(C)C1CCCCN1CC(=O)Nc1cccc(F)c1
InChIInChI=1S/C16H24FN3O/c1-12(18-2)15-8-3-4-9-20(15)11-16(21)19-14-7-5-6-13(17)10-14/h5-7,10,12,15,18H,3-4,8-9,11H2,1-2H3,(H,19,21)
InChIKeyFQCNPVWXOGWZQX-UHFFFAOYSA-N
MW293.39 g/mol
LogP2.23
Rot. Bonds5

About N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide

N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide (PubChem CID 63855022) has the molecular formula C16H24FN3O and a molecular weight of 293.39 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide
PubChem CID63855022
Molecular FormulaC16H24FN3O
Molecular Weight293.39 g/mol
Exact Mass293.19
IUPAC NameN-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide
SMILESCNC(C)C1CCCCN1CC(=O)Nc1cccc(F)c1
InChIInChI=1S/C16H24FN3O/c1-12(18-2)15-8-3-4-9-20(15)11-16(21)19-14-7-5-6-13(17)10-14/h5-7,10,12,15,18H,3-4,8-9,11H2,1-2H3,(H,19,21)
InChIKeyFQCNPVWXOGWZQX-UHFFFAOYSA-N
XLogP2.23
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2R)-2-[(S)-cyano(phenyl)methyl]piperidin-1-yl]-N-(3-fluorophenyl)acetamide
CID 95785842
N-(3-fluorophenyl)-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]acetamide
CID 63853756
N-(3-fluorophenyl)-2-[2-(methylaminomethyl)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119928586
N-(3-ethylphenyl)-2-[2-(1-hydroxyethyl)piperidin-1-yl]acetamide
CID 111106782
N-(3-fluorophenyl)-2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]acetamide
CID 62046362
N-(3-fluorophenyl)-2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]acetamide
CID 51313328
2-[2-(1-aminoethyl)piperidin-1-yl]-N-(3,4-dimethylphenyl)acetamide
CID 63255589
2-(2-formylpiperidin-1-yl)-N-(3-propan-2-ylphenyl)acetamide
CID 62654256
(2R)-N-(3-fluorophenyl)-2-[(1R)-1-hydroxypropyl]piperidine-1-carboxamide
CID 95628326
2-[2-(1-aminoethyl)piperidin-1-yl]-N-(3,4-dimethylphenyl)acetamide;hydrochloride
CID 119911982
2-[4-(2-cyclopentylacetyl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide
CID 9020123
2-[(2S)-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]pyrrolidin-1-yl]-N-(3-fluorophenyl)acetamide
CID 94798443

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide?
The IUPAC name of N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide (CID 63855022) is N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide?
The canonical SMILES for N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide is CNC(C)C1CCCCN1CC(=O)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide?
The InChIKey is FQCNPVWXOGWZQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FN3O/c1-12(18-2)15-8-3-4-9-20(15)11-16(21)19-14-7-5-6-13(17)10-14/h5-7,10,12,15,18H,3-4,8-9,11H2,1-2H3,(H,19,21).
What are the key properties of N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide?
N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide has a molecular weight of 293.39 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-[2-[1-(methylamino)ethyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 63855022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).