N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide

C13H24N2O3 — CID 108504582

IUPACN-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide
SMILESCC1CCN(C(=O)C(=O)NCCCCCO)CC1
InChIInChI=1S/C13H24N2O3/c1-11-5-8-15(9-6-11)13(18)12(17)14-7-3-2-4-10-16/h11,16H,2-10H2,1H3,(H,14,17)
InChIKeyHLBADYXZMHAXMO-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.52
Rot. Bonds5

About N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide

N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide (PubChem CID 108504582) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide.

Molecular Properties

Compound NameN-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide
PubChem CID108504582
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC NameN-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide
SMILESCC1CCN(C(=O)C(=O)NCCCCCO)CC1
InChIInChI=1S/C13H24N2O3/c1-11-5-8-15(9-6-11)13(18)12(17)14-7-3-2-4-10-16/h11,16H,2-10H2,1H3,(H,14,17)
InChIKeyHLBADYXZMHAXMO-UHFFFAOYSA-N
XLogP0.52
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.52
H-Bond Donors ≤ 52
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

2-(4-methylpiperidin-1-yl)-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide
CID 108504537
N-(3-hydroxypropyl)-2-oxo-2-piperidin-1-ylacetamide
CID 108517228
N-decyl-4-methylpiperidine-1-carboxamide
CID 116656754
N-hexyl-4-methylpiperidine-1-carboxamide
CID 71899822
N-[3-(dimethylamino)propyl]-2-(3,5-dimethylpiperidin-1-yl)-2-oxoacetamide
CID 108520549
N-(6-hydroxyhexyl)-4-methylcyclohexane-1-carboxamide
CID 113351776
1-(1-acetylpiperidin-4-yl)-3-(8-hydroxyoctyl)urea
CID 25072675
N-(3-chloropropyl)-2-(3-methylpiperidin-1-yl)-2-oxoacetamide
CID 108513687
2-(4-methylpiperazin-1-yl)-2-oxo-N-pentylacetamide
CID 108517060
N-[3-(diethylamino)propyl]-2-(3,5-dimethylpiperidin-1-yl)-2-oxoacetamide
CID 108520548
N-(3-cyanopropyl)-4-methylpiperidine-1-carboxamide
CID 79160318
8-(methylamino)-1-(4-methylpiperidin-1-yl)octan-1-one
CID 143122837

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide?
The IUPAC name of N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide (CID 108504582) is N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide.
What is the SMILES notation for N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide?
The canonical SMILES for N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide is CC1CCN(C(=O)C(=O)NCCCCCO)CC1.
What is the InChIKey of N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide?
The InChIKey is HLBADYXZMHAXMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-11-5-8-15(9-6-11)13(18)12(17)14-7-3-2-4-10-16/h11,16H,2-10H2,1H3,(H,14,17).
What are the key properties of N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide?
N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide has a molecular weight of 256.35 g/mol, XLogP of 0.52, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxypentyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide is sourced from PubChem (CID 108504582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).