N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide

C13H24N2O3 — CID 110610301

IUPACN-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide
SMILESCCOCC1CCCN(C(=O)CCNC(C)=O)C1
InChIInChI=1S/C13H24N2O3/c1-3-18-10-12-5-4-8-15(9-12)13(17)6-7-14-11(2)16/h12H,3-10H2,1-2H3,(H,14,16)
InChIKeyFPTZQFPKRAKCFW-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.79
Rot. Bonds6

About N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide

N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide (PubChem CID 110610301) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide.

Molecular Properties

Compound NameN-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide
PubChem CID110610301
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC NameN-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide
SMILESCCOCC1CCCN(C(=O)CCNC(C)=O)C1
InChIInChI=1S/C13H24N2O3/c1-3-18-10-12-5-4-8-15(9-12)13(17)6-7-14-11(2)16/h12H,3-10H2,1-2H3,(H,14,16)
InChIKeyFPTZQFPKRAKCFW-UHFFFAOYSA-N
XLogP0.79
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one
CID 129497255
N-[3-[3-(hydroxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide
CID 43422465
N-[3-[(3S)-3-hydroxypiperidin-1-yl]-3-oxopropyl]acetamide
CID 107224919
(3S)-1-(3-acetamidopropanoyl)piperidine-3-carboxylic acid
CID 81125297
N-[2-[3-(methoxymethyl)piperidin-1-yl]-2-oxoethyl]acetamide
CID 164604576
1-[3-(ethoxymethyl)piperidin-1-yl]-4-(4-methoxyphenyl)butane-1,4-dione
CID 110610297
2-(8-azabicyclo[3.2.1]octan-3-yl)-1-[3-(ethoxymethyl)piperidin-1-yl]ethanone
CID 119786515
1-(2-chlorophenyl)-4-[3-(ethoxymethyl)piperidin-1-yl]butane-1,4-dione
CID 110610376
3-amino-1-[3-(ethoxymethyl)piperidin-1-yl]butan-1-one;hydrochloride
CID 119786526
1-[3-(ethoxymethyl)piperidin-1-yl]-5-phenylpentan-1-one
CID 110416532
N-butan-2-yl-3-(ethoxymethyl)piperidine-1-carboxamide
CID 110610311
N-[4-[3-[(4-fluorophenoxy)methyl]piperidin-1-yl]-4-oxobutyl]acetamide
CID 70767223

Frequently Asked Questions

What is the IUPAC name of N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide?
The IUPAC name of N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide (CID 110610301) is N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide.
What is the SMILES notation for N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide?
The canonical SMILES for N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide is CCOCC1CCCN(C(=O)CCNC(C)=O)C1.
What is the InChIKey of N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide?
The InChIKey is FPTZQFPKRAKCFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-3-18-10-12-5-4-8-15(9-12)13(17)6-7-14-11(2)16/h12H,3-10H2,1-2H3,(H,14,16).
What are the key properties of N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide?
N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide has a molecular weight of 256.35 g/mol, XLogP of 0.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3-(ethoxymethyl)piperidin-1-yl]-3-oxopropyl]acetamide is sourced from PubChem (CID 110610301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).