4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide

C15H20N2O3 — CID 18166061

IUPAC4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide
SMILESCC1CCN(C(=O)COc2ccc(C(N)=O)cc2)CC1
InChIInChI=1S/C15H20N2O3/c1-11-6-8-17(9-7-11)14(18)10-20-13-4-2-12(3-5-13)15(16)19/h2-5,11H,6-10H2,1H3,(H2,16,19)
InChIKeyWILHYUBTPHNIBJ-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.42
Rot. Bonds4

About 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide

4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide (PubChem CID 18166061) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide
PubChem CID18166061
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide
SMILESCC1CCN(C(=O)COc2ccc(C(N)=O)cc2)CC1
InChIInChI=1S/C15H20N2O3/c1-11-6-8-17(9-7-11)14(18)10-20-13-4-2-12(3-5-13)15(16)19/h2-5,11H,6-10H2,1H3,(H2,16,19)
InChIKeyWILHYUBTPHNIBJ-UHFFFAOYSA-N
XLogP1.42
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzoate
CID 52890363
4-[2-(azocan-1-yl)-2-oxoethoxy]benzamide
CID 8566237
2-[4-(aminomethyl)phenoxy]-1-(4-methylazepan-1-yl)ethanone
CID 63622570
4-[2-[3-(4-methylphenyl)pyrrolidin-1-yl]-2-oxoethoxy]benzamide
CID 167987352
2-(3,4-dimethylphenoxy)-1-(4-methylpiperidin-1-yl)ethanone
CID 797864
4-[2-(4-ethylpiperidin-1-yl)-2-oxoethoxy]benzenecarbothioamide
CID 61421699
2-(3,5-dimethylphenoxy)-1-(4-methylpiperidin-1-yl)ethanone
CID 21173488
2-(4-bromo-3-methylphenoxy)-1-(4-methylpiperidin-1-yl)ethanone
CID 730217
2-(4-chloro-3-methylphenoxy)-1-(4-methylpiperidin-1-yl)ethanone
CID 883850
(2R,3R)-1-[2-(4-carbamoylphenoxy)acetyl]-2-methylpiperidine-3-carboxylic acid
CID 122115605
4-[2-[4-(2-hydroxybutyl)piperazin-1-yl]-2-oxoethoxy]benzamide
CID 56803124
1-(4-aminopiperidin-1-yl)-2-(4-methoxyphenoxy)ethanone
CID 82042591

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide?
The IUPAC name of 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide (CID 18166061) is 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide.
What is the SMILES notation for 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide?
The canonical SMILES for 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide is CC1CCN(C(=O)COc2ccc(C(N)=O)cc2)CC1.
What is the InChIKey of 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide?
The InChIKey is WILHYUBTPHNIBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-11-6-8-17(9-7-11)14(18)10-20-13-4-2-12(3-5-13)15(16)19/h2-5,11H,6-10H2,1H3,(H2,16,19).
What are the key properties of 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide?
4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide has a molecular weight of 276.34 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzamide is sourced from PubChem (CID 18166061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).