4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide

C14H17ClN2O3 — CID 43391762

IUPAC4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide
SMILESO=C(NCC(=O)N1CCC(O)CC1)c1ccc(Cl)cc1
InChIInChI=1S/C14H17ClN2O3/c15-11-3-1-10(2-4-11)14(20)16-9-13(19)17-7-5-12(18)6-8-17/h1-4,12,18H,5-9H2,(H,16,20)
InChIKeyUQBQWEPBHNIBPP-UHFFFAOYSA-N
MW296.75 g/mol
LogP1.05
Rot. Bonds3

About 4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide

4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide (PubChem CID 43391762) has the molecular formula C14H17ClN2O3 and a molecular weight of 296.75 g/mol. Its IUPAC name is 4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide
PubChem CID43391762
Molecular FormulaC14H17ClN2O3
Molecular Weight296.75 g/mol
Exact Mass296.09
IUPAC Name4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide
SMILESO=C(NCC(=O)N1CCC(O)CC1)c1ccc(Cl)cc1
InChIInChI=1S/C14H17ClN2O3/c15-11-3-1-10(2-4-11)14(20)16-9-13(19)17-7-5-12(18)6-8-17/h1-4,12,18H,5-9H2,(H,16,20)
InChIKeyUQBQWEPBHNIBPP-UHFFFAOYSA-N
XLogP1.05
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.75
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[2-[4-(hydroxymethyl)piperidin-1-yl]-2-oxoethyl]benzamide
CID 60958174
N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]-4-methylbenzamide
CID 43391737
3,4-difluoro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide
CID 110901522
N-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-4-chlorobenzamide
CID 112991929
N-[2-(4-benzoylpiperidin-1-yl)-2-oxoethyl]-4-chlorobenzamide
CID 41308736
1-[2-[(4-chlorobenzoyl)amino]acetyl]-N-phenylpiperidine-4-carboxamide
CID 26462507
N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]-3,5-dimethylbenzamide
CID 110878722
4-chloro-N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]benzamide
CID 4779688
4-chloro-N-[2-oxo-2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]benzamide
CID 17436936
4-[[2-(2,4-dichlorophenoxy)phenyl]sulfamoyl]-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide
CID 24986737
N-[2-(4-aminopiperidin-1-yl)-2-oxoethyl]-3,4-dichlorobenzamide
CID 119373866
N-[2-(4-benzamidopiperidin-1-yl)-2-oxoethyl]benzamide
CID 34423890

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide?
The IUPAC name of 4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide (CID 43391762) is 4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide.
What is the SMILES notation for 4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide?
The canonical SMILES for 4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide is O=C(NCC(=O)N1CCC(O)CC1)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide?
The InChIKey is UQBQWEPBHNIBPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O3/c15-11-3-1-10(2-4-11)14(20)16-9-13(19)17-7-5-12(18)6-8-17/h1-4,12,18H,5-9H2,(H,16,20).
What are the key properties of 4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide?
4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide has a molecular weight of 296.75 g/mol, XLogP of 1.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]benzamide is sourced from PubChem (CID 43391762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).