N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide

C13H24N2O3 — CID 113159997

IUPACN-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
SMILESCOCCCN(CC(=O)N1CCCCC1)C(C)=O
InChIInChI=1S/C13H24N2O3/c1-12(16)15(9-6-10-18-2)11-13(17)14-7-4-3-5-8-14/h3-11H2,1-2H3
InChIKeyWIYULROVCBEVPR-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.88
Rot. Bonds6

About N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide

N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide (PubChem CID 113159997) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
PubChem CID113159997
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC NameN-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
SMILESCOCCCN(CC(=O)N1CCCCC1)C(C)=O
InChIInChI=1S/C13H24N2O3/c1-12(16)15(9-6-10-18-2)11-13(17)14-7-4-3-5-8-14/h3-11H2,1-2H3
InChIKeyWIYULROVCBEVPR-UHFFFAOYSA-N
XLogP0.88
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-oxo-2-pyrrolidin-1-ylethyl)-N-pentylacetamide
CID 113166654
N-(2-methoxyethyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide
CID 113159876
N-(3-methoxypropyl)-N-[2-oxo-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethyl]acetamide
CID 113160057
N-[2-(azepan-1-yl)-2-oxoethyl]-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 113164704
N-(3-methoxypropyl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)methanesulfonamide
CID 113137802
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(oxolan-2-ylmethyl)acetamide
CID 113160273
2-[acetyl(3-methoxypropyl)amino]-N-cycloheptylacetamide
CID 113160065
3-methoxy-1-piperidin-1-ylpropan-1-one
CID 15751929
N-[2-(3-methoxyphenyl)ethyl]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 113164639
N-butyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]acetamide
CID 113158629
N,N-bis(2-methoxyethyl)piperidine-1-carboxamide
CID 115578688
ethyl 4-[2-[acetyl(pentyl)amino]acetyl]piperazine-1-carboxylate
CID 113166709

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide?
The IUPAC name of N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide (CID 113159997) is N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide.
What is the SMILES notation for N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide?
The canonical SMILES for N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide is COCCCN(CC(=O)N1CCCCC1)C(C)=O.
What is the InChIKey of N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide?
The InChIKey is WIYULROVCBEVPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-12(16)15(9-6-10-18-2)11-13(17)14-7-4-3-5-8-14/h3-11H2,1-2H3.
What are the key properties of N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide?
N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide has a molecular weight of 256.35 g/mol, XLogP of 0.88, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide is sourced from PubChem (CID 113159997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).