5-hydroxy-6-(2-hydroxyethoxy)hexanamide

C8H17NO4 — CID 175269761

IUPAC5-hydroxy-6-(2-hydroxyethoxy)hexanamide
SMILESNC(=O)CCCC(O)COCCO
InChIInChI=1S/C8H17NO4/c9-8(12)3-1-2-7(11)6-13-5-4-10/h7,10-11H,1-6H2,(H2,9,12)
InChIKeyZRAOKXKQDQHVIB-UHFFFAOYSA-N
MW191.23 g/mol
LogP-0.99
Rot. Bonds8

About 5-hydroxy-6-(2-hydroxyethoxy)hexanamide

5-hydroxy-6-(2-hydroxyethoxy)hexanamide (PubChem CID 175269761) has the molecular formula C8H17NO4 and a molecular weight of 191.23 g/mol. Its IUPAC name is 5-hydroxy-6-(2-hydroxyethoxy)hexanamide.

Molecular Properties

Compound Name5-hydroxy-6-(2-hydroxyethoxy)hexanamide
PubChem CID175269761
Molecular FormulaC8H17NO4
Molecular Weight191.23 g/mol
Exact Mass191.12
IUPAC Name5-hydroxy-6-(2-hydroxyethoxy)hexanamide
SMILESNC(=O)CCCC(O)COCCO
InChIInChI=1S/C8H17NO4/c9-8(12)3-1-2-7(11)6-13-5-4-10/h7,10-11H,1-6H2,(H2,9,12)
InChIKeyZRAOKXKQDQHVIB-UHFFFAOYSA-N
XLogP-0.99
TPSA92.78 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 5-0.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-amino-1-(2-hydroxyethoxy)pentan-2-ol
CID 21493098
1,8-bis[2-(2-hydroxyethoxy)ethoxy]octane-2,7-diol
CID 142397445
acetic acid;1-(2-hydroxyethoxy)hexan-2-ol
CID 87319718
1-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-2-ol
CID 140523631
butanedioic acid;1-(2-hydroxyethoxy)hexan-2-ol;1-(2-hydroxyethoxy)propan-2-ol
CID 161461664
butanedioic acid;1-[2-(2-hydroxyethoxy)ethoxy]-13-sulfanyltridecan-2-ol
CID 87720092
4-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]butanamide
CID 178004606
azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol
CID 87459588
1,8-dimethanidyloxyoctane-2,7-diol;bis(1,3-dimethanidyloxypropan-2-ol);bis(1-(2-hydroxyethoxy)-3-methanidyloxypropan-2-ol);tetrakis(rutherfordium)
CID 177274110
1-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]heptan-2-ol
CID 140523672
3-(2-hydroxy-3-methoxypropoxy)propanamide
CID 172515689
1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-13-sulfanyltridecan-2-ol
CID 134163545

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-6-(2-hydroxyethoxy)hexanamide?
The IUPAC name of 5-hydroxy-6-(2-hydroxyethoxy)hexanamide (CID 175269761) is 5-hydroxy-6-(2-hydroxyethoxy)hexanamide.
What is the SMILES notation for 5-hydroxy-6-(2-hydroxyethoxy)hexanamide?
The canonical SMILES for 5-hydroxy-6-(2-hydroxyethoxy)hexanamide is NC(=O)CCCC(O)COCCO.
What is the InChIKey of 5-hydroxy-6-(2-hydroxyethoxy)hexanamide?
The InChIKey is ZRAOKXKQDQHVIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO4/c9-8(12)3-1-2-7(11)6-13-5-4-10/h7,10-11H,1-6H2,(H2,9,12).
What are the key properties of 5-hydroxy-6-(2-hydroxyethoxy)hexanamide?
5-hydroxy-6-(2-hydroxyethoxy)hexanamide has a molecular weight of 191.23 g/mol, XLogP of -0.99, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-6-(2-hydroxyethoxy)hexanamide is sourced from PubChem (CID 175269761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).