N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide

C14H27N3O2 — CID 108517232

IUPACN-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide
SMILESCCN(CC)CCCNC(=O)C(=O)N1CCCCC1
InChIInChI=1S/C14H27N3O2/c1-3-16(4-2)10-8-9-15-13(18)14(19)17-11-6-5-7-12-17/h3-12H2,1-2H3,(H,15,18)
InChIKeyCHAQFTZDFDBSEV-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.85
Rot. Bonds6

About N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide

N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide (PubChem CID 108517232) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide
PubChem CID108517232
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC NameN-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide
SMILESCCN(CC)CCCNC(=O)C(=O)N1CCCCC1
InChIInChI=1S/C14H27N3O2/c1-3-16(4-2)10-8-9-15-13(18)14(19)17-11-6-5-7-12-17/h3-12H2,1-2H3,(H,15,18)
InChIKeyCHAQFTZDFDBSEV-UHFFFAOYSA-N
XLogP0.85
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(diethylamino)propyl]-2-(3,5-dimethylpiperidin-1-yl)-2-oxoacetamide
CID 108520548
N-(3-hydroxypropyl)-2-oxo-2-piperidin-1-ylacetamide
CID 108517228
2-(azepan-1-yl)-N-ethyl-2-oxoacetamide
CID 108521159
N-[3-(diethylamino)propyl]-N'-ethyl-N'-(2-hydroxyethyl)oxamide
CID 108524636
ethyl 2-[3-(diethylamino)propylamino]-2-oxoacetate
CID 3412732
N-[3-(diethylamino)propyl]-2-oxo-2-[1-(2-oxo-2-piperidin-1-ylethyl)indol-3-yl]acetamide
CID 7162399
1-[3-(diethylamino)propyl]-3-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]thiourea
CID 19445685
1-(azepan-1-yl)-2-[butyl(ethyl)amino]ethanone
CID 86910796
2-(4-methylpiperazin-1-yl)-2-oxo-N-pentylacetamide
CID 108517060
N'-cycloheptyl-N-[3-(diethylamino)propyl]butanediamide
CID 46993948
N-(2-hydroxy-2-methylpropyl)-2-oxo-2-piperidin-1-ylacetamide
CID 176960450
N-ethyl-N-(2-hydroxyethyl)-2-oxo-2-piperidin-1-ylacetamide
CID 108517236

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide?
The IUPAC name of N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide (CID 108517232) is N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide?
The canonical SMILES for N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide is CCN(CC)CCCNC(=O)C(=O)N1CCCCC1.
What is the InChIKey of N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide?
The InChIKey is CHAQFTZDFDBSEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-3-16(4-2)10-8-9-15-13(18)14(19)17-11-6-5-7-12-17/h3-12H2,1-2H3,(H,15,18).
What are the key properties of N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide?
N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide has a molecular weight of 269.39 g/mol, XLogP of 0.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylamino)propyl]-2-oxo-2-piperidin-1-ylacetamide is sourced from PubChem (CID 108517232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).