4-hydroxy-N-(2-hydroxyethyl)hexanamide

C8H17NO3 — CID 24783258

IUPAC4-hydroxy-N-(2-hydroxyethyl)hexanamide
SMILESCCC(O)CCC(=O)NCCO
InChIInChI=1S/C8H17NO3/c1-2-7(11)3-4-8(12)9-5-6-10/h7,10-11H,2-6H2,1H3,(H,9,12)
InChIKeyVWNJLHMJYMOYEG-UHFFFAOYSA-N
MW175.23 g/mol
LogP-0.35
Rot. Bonds6

About 4-hydroxy-N-(2-hydroxyethyl)hexanamide

4-hydroxy-N-(2-hydroxyethyl)hexanamide (PubChem CID 24783258) has the molecular formula C8H17NO3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 4-hydroxy-N-(2-hydroxyethyl)hexanamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-hydroxyethyl)hexanamide
PubChem CID24783258
Molecular FormulaC8H17NO3
Molecular Weight175.23 g/mol
Exact Mass175.12
IUPAC Name4-hydroxy-N-(2-hydroxyethyl)hexanamide
SMILESCCC(O)CCC(=O)NCCO
InChIInChI=1S/C8H17NO3/c1-2-7(11)3-4-8(12)9-5-6-10/h7,10-11H,2-6H2,1H3,(H,9,12)
InChIKeyVWNJLHMJYMOYEG-UHFFFAOYSA-N
XLogP-0.35
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 5-0.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-hydroxyethyl)hexanamide?
The IUPAC name of 4-hydroxy-N-(2-hydroxyethyl)hexanamide (CID 24783258) is 4-hydroxy-N-(2-hydroxyethyl)hexanamide.
What is the SMILES notation for 4-hydroxy-N-(2-hydroxyethyl)hexanamide?
The canonical SMILES for 4-hydroxy-N-(2-hydroxyethyl)hexanamide is CCC(O)CCC(=O)NCCO.
What is the InChIKey of 4-hydroxy-N-(2-hydroxyethyl)hexanamide?
The InChIKey is VWNJLHMJYMOYEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO3/c1-2-7(11)3-4-8(12)9-5-6-10/h7,10-11H,2-6H2,1H3,(H,9,12).
What are the key properties of 4-hydroxy-N-(2-hydroxyethyl)hexanamide?
4-hydroxy-N-(2-hydroxyethyl)hexanamide has a molecular weight of 175.23 g/mol, XLogP of -0.35, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-hydroxyethyl)hexanamide is sourced from PubChem (CID 24783258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).