N-(3-butoxypropyl)-5-hydroxypentanamide

C12H25NO3 — CID 115886729

IUPACN-(3-butoxypropyl)-5-hydroxypentanamide
SMILESCCCCOCCCNC(=O)CCCCO
InChIInChI=1S/C12H25NO3/c1-2-3-10-16-11-6-8-13-12(15)7-4-5-9-14/h14H,2-11H2,1H3,(H,13,15)
InChIKeyWCYIZCYTEGIIAE-UHFFFAOYSA-N
MW231.34 g/mol
LogP1.47
Rot. Bonds11

About N-(3-butoxypropyl)-5-hydroxypentanamide

N-(3-butoxypropyl)-5-hydroxypentanamide (PubChem CID 115886729) has the molecular formula C12H25NO3 and a molecular weight of 231.34 g/mol. Its IUPAC name is N-(3-butoxypropyl)-5-hydroxypentanamide.

Molecular Properties

Compound NameN-(3-butoxypropyl)-5-hydroxypentanamide
PubChem CID115886729
Molecular FormulaC12H25NO3
Molecular Weight231.34 g/mol
Exact Mass231.18
IUPAC NameN-(3-butoxypropyl)-5-hydroxypentanamide
SMILESCCCCOCCCNC(=O)CCCCO
InChIInChI=1S/C12H25NO3/c1-2-3-10-16-11-6-8-13-12(15)7-4-5-9-14/h14H,2-11H2,1H3,(H,13,15)
InChIKeyWCYIZCYTEGIIAE-UHFFFAOYSA-N
XLogP1.47
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(3-butoxypropyl)-N-butylbutanediamide
CID 4602776
N'-(3-butoxypropyl)-N-heptylbutanediamide
CID 5116303
6-hydroxy-N-tetradecylhexanamide
CID 20542961
18-hydroxy-N-octadecyloctadecanamide
CID 10984479
N-butyl-6-hydroxyhexanamide;ethane
CID 145076581
N-[3-(2-aminoethoxy)propyl]dodecanamide
CID 106307810
N-(3-hydroxypropyl)docosanamide
CID 87200048
N,N'-bis(3-dodecoxypropyl)decanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]dodecanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]tridecanediamide;N,N'-bis(3-methoxypropyl)decanediamide;N,N'-bis(3-methoxypropyl)dodecanediamide;N,N'-bis(3-methoxypropyl)icosanediamide
CID 161275900
6-hydroxy-N-(3-methoxypropyl)hexanamide
CID 177359571
5-bromo-N-(2-butoxyethyl)pentanamide
CID 10016485
5-oxo-N-[3-[2-[2-[3-(pentanoylamino)propoxy]ethoxy]ethoxy]propyl]hexanamide
CID 129222312
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]hexadecanamide
CID 102228656

Frequently Asked Questions

What is the IUPAC name of N-(3-butoxypropyl)-5-hydroxypentanamide?
The IUPAC name of N-(3-butoxypropyl)-5-hydroxypentanamide (CID 115886729) is N-(3-butoxypropyl)-5-hydroxypentanamide.
What is the SMILES notation for N-(3-butoxypropyl)-5-hydroxypentanamide?
The canonical SMILES for N-(3-butoxypropyl)-5-hydroxypentanamide is CCCCOCCCNC(=O)CCCCO.
What is the InChIKey of N-(3-butoxypropyl)-5-hydroxypentanamide?
The InChIKey is WCYIZCYTEGIIAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO3/c1-2-3-10-16-11-6-8-13-12(15)7-4-5-9-14/h14H,2-11H2,1H3,(H,13,15).
What are the key properties of N-(3-butoxypropyl)-5-hydroxypentanamide?
N-(3-butoxypropyl)-5-hydroxypentanamide has a molecular weight of 231.34 g/mol, XLogP of 1.47, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-butoxypropyl)-5-hydroxypentanamide is sourced from PubChem (CID 115886729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).