5-hydroxy-N-methyl-N-pentan-2-ylpentanamide

C11H23NO2 — CID 79199050

IUPAC5-hydroxy-N-methyl-N-pentan-2-ylpentanamide
SMILESCCCC(C)N(C)C(=O)CCCCO
InChIInChI=1S/C11H23NO2/c1-4-7-10(2)12(3)11(14)8-5-6-9-13/h10,13H,4-9H2,1-3H3
InChIKeyNNMJLHWXNKJCIX-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.80
Rot. Bonds7

About 5-hydroxy-N-methyl-N-pentan-2-ylpentanamide

5-hydroxy-N-methyl-N-pentan-2-ylpentanamide (PubChem CID 79199050) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 5-hydroxy-N-methyl-N-pentan-2-ylpentanamide.

Molecular Properties

Compound Name5-hydroxy-N-methyl-N-pentan-2-ylpentanamide
PubChem CID79199050
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name5-hydroxy-N-methyl-N-pentan-2-ylpentanamide
SMILESCCCC(C)N(C)C(=O)CCCCO
InChIInChI=1S/C11H23NO2/c1-4-7-10(2)12(3)11(14)8-5-6-9-13/h10,13H,4-9H2,1-3H3
InChIKeyNNMJLHWXNKJCIX-UHFFFAOYSA-N
XLogP1.80
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-methyl-N-pentan-2-ylpentanamide?
The IUPAC name of 5-hydroxy-N-methyl-N-pentan-2-ylpentanamide (CID 79199050) is 5-hydroxy-N-methyl-N-pentan-2-ylpentanamide.
What is the SMILES notation for 5-hydroxy-N-methyl-N-pentan-2-ylpentanamide?
The canonical SMILES for 5-hydroxy-N-methyl-N-pentan-2-ylpentanamide is CCCC(C)N(C)C(=O)CCCCO.
What is the InChIKey of 5-hydroxy-N-methyl-N-pentan-2-ylpentanamide?
The InChIKey is NNMJLHWXNKJCIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-4-7-10(2)12(3)11(14)8-5-6-9-13/h10,13H,4-9H2,1-3H3.
What are the key properties of 5-hydroxy-N-methyl-N-pentan-2-ylpentanamide?
5-hydroxy-N-methyl-N-pentan-2-ylpentanamide has a molecular weight of 201.31 g/mol, XLogP of 1.80, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-methyl-N-pentan-2-ylpentanamide is sourced from PubChem (CID 79199050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).