N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide

C18H28N2O3 — CID 110909879

IUPACN-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide
SMILESCCCCCOCC(=O)Nc1ccccc1N1CCC(O)CC1
InChIInChI=1S/C18H28N2O3/c1-2-3-6-13-23-14-18(22)19-16-7-4-5-8-17(16)20-11-9-15(21)10-12-20/h4-5,7-8,15,21H,2-3,6,9-14H2,1H3,(H,19,22)
InChIKeyDAHKFYQRNZSOHO-UHFFFAOYSA-N
MW320.43 g/mol
LogP2.79
Rot. Bonds8

About N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide

N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide (PubChem CID 110909879) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide.

Molecular Properties

Compound NameN-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide
PubChem CID110909879
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC NameN-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide
SMILESCCCCCOCC(=O)Nc1ccccc1N1CCC(O)CC1
InChIInChI=1S/C18H28N2O3/c1-2-3-6-13-23-14-18(22)19-16-7-4-5-8-17(16)20-11-9-15(21)10-12-20/h4-5,7-8,15,21H,2-3,6,9-14H2,1H3,(H,19,22)
InChIKeyDAHKFYQRNZSOHO-UHFFFAOYSA-N
XLogP2.79
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[2-[(2-butoxyacetyl)amino]phenyl]pyrazole-3-carboxylic acid
CID 119206655
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-4-(methylamino)butanamide;dihydrochloride
CID 119859796
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-3,4-dimethylpentanamide
CID 110929437
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-3-(4-methylpentan-2-yloxy)propanamide
CID 71922108
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-3,4,4-trimethylpentanamide
CID 111109805
2-(2-aminoethoxy)-N-(2-morpholin-4-ylphenyl)acetamide
CID 79473131
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 111537095
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-methyl-3-(methylamino)propanamide
CID 119859815
3-ethyl-N-[2-(4-hydroxypiperidin-1-yl)phenyl]thiophene-2-carboxamide
CID 110903804
3-(2-aminophenyl)-N-[2-(4-hydroxypiperidin-1-yl)phenyl]propanamide;dihydrochloride
CID 120612614
3-amino-N-[2-(4-hydroxypiperidin-1-yl)phenyl]-3-phenylpropanamide;dihydrochloride
CID 119953315
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide
CID 111462834

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide?
The IUPAC name of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide (CID 110909879) is N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide.
What is the SMILES notation for N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide?
The canonical SMILES for N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide is CCCCCOCC(=O)Nc1ccccc1N1CCC(O)CC1.
What is the InChIKey of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide?
The InChIKey is DAHKFYQRNZSOHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3/c1-2-3-6-13-23-14-18(22)19-16-7-4-5-8-17(16)20-11-9-15(21)10-12-20/h4-5,7-8,15,21H,2-3,6,9-14H2,1H3,(H,19,22).
What are the key properties of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide?
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide has a molecular weight of 320.43 g/mol, XLogP of 2.79, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-pentoxyacetamide is sourced from PubChem (CID 110909879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).