N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide

C13H26N2O2 — CID 79192601

IUPACN-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide
SMILESCCN1CCC(N(C)C(=O)CCC(C)O)CC1
InChIInChI=1S/C13H26N2O2/c1-4-15-9-7-12(8-10-15)14(3)13(17)6-5-11(2)16/h11-12,16H,4-10H2,1-3H3
InChIKeyZRLVLWAGHGEDTA-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.09
Rot. Bonds5

About N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide

N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide (PubChem CID 79192601) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide
PubChem CID79192601
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide
SMILESCCN1CCC(N(C)C(=O)CCC(C)O)CC1
InChIInChI=1S/C13H26N2O2/c1-4-15-9-7-12(8-10-15)14(3)13(17)6-5-11(2)16/h11-12,16H,4-10H2,1-3H3
InChIKeyZRLVLWAGHGEDTA-UHFFFAOYSA-N
XLogP1.09
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide (CID 79192601) is N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide is CCN1CCC(N(C)C(=O)CCC(C)O)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide?
The InChIKey is ZRLVLWAGHGEDTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-4-15-9-7-12(8-10-15)14(3)13(17)6-5-11(2)16/h11-12,16H,4-10H2,1-3H3.
What are the key properties of N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide?
N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide has a molecular weight of 242.36 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)-4-hydroxy-N-methylpentanamide is sourced from PubChem (CID 79192601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).