N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide

C11H23NO2 — CID 115870048

IUPACN-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide
SMILESCC(C)CCC(=O)NC(C)(C)CCO
InChIInChI=1S/C11H23NO2/c1-9(2)5-6-10(14)12-11(3,4)7-8-13/h9,13H,5-8H2,1-4H3,(H,12,14)
InChIKeyFOTIYFLJFLWKJY-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.70
Rot. Bonds6

About N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide

N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide (PubChem CID 115870048) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide.

Molecular Properties

Compound NameN-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide
PubChem CID115870048
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide
SMILESCC(C)CCC(=O)NC(C)(C)CCO
InChIInChI=1S/C11H23NO2/c1-9(2)5-6-10(14)12-11(3,4)7-8-13/h9,13H,5-8H2,1-4H3,(H,12,14)
InChIKeyFOTIYFLJFLWKJY-UHFFFAOYSA-N
XLogP1.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide?
The IUPAC name of N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide (CID 115870048) is N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide.
What is the SMILES notation for N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide?
The canonical SMILES for N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide is CC(C)CCC(=O)NC(C)(C)CCO.
What is the InChIKey of N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide?
The InChIKey is FOTIYFLJFLWKJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-9(2)5-6-10(14)12-11(3,4)7-8-13/h9,13H,5-8H2,1-4H3,(H,12,14).
What are the key properties of N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide?
N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide has a molecular weight of 201.31 g/mol, XLogP of 1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide is sourced from PubChem (CID 115870048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).