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

C15H21FN2O2 — CID 103829910

IUPAC4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
SMILESCN1CCC(CCNC(=O)c2ccc(F)cc2O)CC1
InChIInChI=1S/C15H21FN2O2/c1-18-8-5-11(6-9-18)4-7-17-15(20)13-3-2-12(16)10-14(13)19/h2-3,10-11,19H,4-9H2,1H3,(H,17,20)
InChIKeyMWKPHDZELSWPLI-UHFFFAOYSA-N
MW280.34 g/mol
LogP1.99
Rot. Bonds4

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

4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide (PubChem CID 103829910) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is 4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
PubChem CID103829910
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC Name4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
SMILESCN1CCC(CCNC(=O)c2ccc(F)cc2O)CC1
InChIInChI=1S/C15H21FN2O2/c1-18-8-5-11(6-9-18)4-7-17-15(20)13-3-2-12(16)10-14(13)19/h2-3,10-11,19H,4-9H2,1H3,(H,17,20)
InChIKeyMWKPHDZELSWPLI-UHFFFAOYSA-N
XLogP1.99
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-5-fluoro-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 114514864
N-(3-cyclopentylpropyl)-4-fluoro-2-hydroxybenzamide
CID 106011705
2,4-diamino-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 114514867
3,4,5-trifluoro-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 115610737
2-methoxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 99970994
5-amino-2-fluoro-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 103296905
N-(3,3-dimethylbutyl)-4-fluoro-2-hydroxybenzamide
CID 113304540
2-bromo-6-fluoro-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 115678882
2-chloro-N-[2-(1-methylpiperidin-4-yl)ethyl]-5-sulfanylbenzamide
CID 107036335
2-amino-3-fluoro-N-[2-(1-methylpiperidin-4-yl)ethyl]pyridine-4-carboxamide
CID 105387682
2-fluoro-N-[2-(1-methylpiperidin-4-yl)ethyl]pyridine-4-carboxamide
CID 115601906
N-(2-cyclohexylethyl)-2-hydroxy-4-methylbenzamide
CID 63526438

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide?
The IUPAC name of 4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide (CID 103829910) is 4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide.
What is the SMILES notation for 4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide?
The canonical SMILES for 4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide is CN1CCC(CCNC(=O)c2ccc(F)cc2O)CC1.
What is the InChIKey of 4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide?
The InChIKey is MWKPHDZELSWPLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-18-8-5-11(6-9-18)4-7-17-15(20)13-3-2-12(16)10-14(13)19/h2-3,10-11,19H,4-9H2,1H3,(H,17,20).
What are the key properties of 4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide?
4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide has a molecular weight of 280.34 g/mol, XLogP of 1.99, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-hydroxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide is sourced from PubChem (CID 103829910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).