2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide

C15H19FN2O3 — CID 103901184

IUPAC2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide
SMILESCC1CCN(C(=O)CNC(=O)c2ccccc2F)CC1O
InChIInChI=1S/C15H19FN2O3/c1-10-6-7-18(9-13(10)19)14(20)8-17-15(21)11-4-2-3-5-12(11)16/h2-5,10,13,19H,6-9H2,1H3,(H,17,21)
InChIKeyFVYFRPRXLWFDMS-UHFFFAOYSA-N
MW294.33 g/mol
LogP0.78
Rot. Bonds3

About 2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide

2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide (PubChem CID 103901184) has the molecular formula C15H19FN2O3 and a molecular weight of 294.33 g/mol. Its IUPAC name is 2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide
PubChem CID103901184
Molecular FormulaC15H19FN2O3
Molecular Weight294.33 g/mol
Exact Mass294.14
IUPAC Name2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide
SMILESCC1CCN(C(=O)CNC(=O)c2ccccc2F)CC1O
InChIInChI=1S/C15H19FN2O3/c1-10-6-7-18(9-13(10)19)14(20)8-17-15(21)11-4-2-3-5-12(11)16/h2-5,10,13,19H,6-9H2,1H3,(H,17,21)
InChIKeyFVYFRPRXLWFDMS-UHFFFAOYSA-N
XLogP0.78
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3,4-dihydroxypyrrolidin-1-yl)-2-oxoethyl]-2-fluorobenzamide
CID 106671856
2-bromo-N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]benzamide
CID 114680413
ethyl 4-[2-[(2-fluorobenzoyl)amino]acetyl]piperazine-1-carboxylate
CID 2568966
2-fluoro-N-[2-[3-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]benzamide
CID 47018605
N-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-2-fluorobenzamide
CID 17451155
2-chloro-6-fluoro-N-[2-[4-[(2-fluorobenzoyl)amino]piperidin-1-yl]-2-oxoethyl]benzamide
CID 86898999
2-fluoro-N-[3-oxo-3-(3-phenoxypyrrolidin-1-yl)propyl]benzamide
CID 118778125
(2-bromo-3-fluorophenyl)-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 102958136
2-fluoro-N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide
CID 43045470
3-fluoro-N-[2-[(3R)-3-hydroxypyrrolidin-1-yl]-2-oxoethyl]benzamide
CID 66261045
2-(ethylamino)-1-(3-hydroxy-4-methylpiperidin-1-yl)ethanone
CID 102957086
N-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl]-2-fluorobenzamide
CID 27510219

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide (CID 103901184) is 2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide is CC1CCN(C(=O)CNC(=O)c2ccccc2F)CC1O.
What is the InChIKey of 2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
The InChIKey is FVYFRPRXLWFDMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O3/c1-10-6-7-18(9-13(10)19)14(20)8-17-15(21)11-4-2-3-5-12(11)16/h2-5,10,13,19H,6-9H2,1H3,(H,17,21).
What are the key properties of 2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide has a molecular weight of 294.33 g/mol, XLogP of 0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-(3-hydroxy-4-methylpiperidin-1-yl)-2-oxoethyl]benzamide is sourced from PubChem (CID 103901184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).