5-hydroxy-N,2,4-trimethylpentanamide

C8H17NO2 — CID 157214325

IUPAC5-hydroxy-N,2,4-trimethylpentanamide
SMILESCNC(=O)C(C)CC(C)CO
InChIInChI=1S/C8H17NO2/c1-6(5-10)4-7(2)8(11)9-3/h6-7,10H,4-5H2,1-3H3,(H,9,11)
InChIKeyASFYWTRNMBAKLC-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.39
Rot. Bonds4

About 5-hydroxy-N,2,4-trimethylpentanamide

5-hydroxy-N,2,4-trimethylpentanamide (PubChem CID 157214325) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 5-hydroxy-N,2,4-trimethylpentanamide.

Molecular Properties

Compound Name5-hydroxy-N,2,4-trimethylpentanamide
PubChem CID157214325
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name5-hydroxy-N,2,4-trimethylpentanamide
SMILESCNC(=O)C(C)CC(C)CO
InChIInChI=1S/C8H17NO2/c1-6(5-10)4-7(2)8(11)9-3/h6-7,10H,4-5H2,1-3H3,(H,9,11)
InChIKeyASFYWTRNMBAKLC-UHFFFAOYSA-N
XLogP0.39
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N,2,4-trimethylpentanamide?
The IUPAC name of 5-hydroxy-N,2,4-trimethylpentanamide (CID 157214325) is 5-hydroxy-N,2,4-trimethylpentanamide.
What is the SMILES notation for 5-hydroxy-N,2,4-trimethylpentanamide?
The canonical SMILES for 5-hydroxy-N,2,4-trimethylpentanamide is CNC(=O)C(C)CC(C)CO.
What is the InChIKey of 5-hydroxy-N,2,4-trimethylpentanamide?
The InChIKey is ASFYWTRNMBAKLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-6(5-10)4-7(2)8(11)9-3/h6-7,10H,4-5H2,1-3H3,(H,9,11).
What are the key properties of 5-hydroxy-N,2,4-trimethylpentanamide?
5-hydroxy-N,2,4-trimethylpentanamide has a molecular weight of 159.23 g/mol, XLogP of 0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N,2,4-trimethylpentanamide is sourced from PubChem (CID 157214325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).