N-(5-hydroxypentyl)butanamide

C9H19NO2 — CID 15732298

IUPACN-(5-hydroxypentyl)butanamide
SMILESCCCC(=O)NCCCCCO
InChIInChI=1S/C9H19NO2/c1-2-6-9(12)10-7-4-3-5-8-11/h11H,2-8H2,1H3,(H,10,12)
InChIKeyOIZZSONRYGZZGA-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.07
Rot. Bonds7

About N-(5-hydroxypentyl)butanamide

N-(5-hydroxypentyl)butanamide (PubChem CID 15732298) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is N-(5-hydroxypentyl)butanamide.

Molecular Properties

Compound NameN-(5-hydroxypentyl)butanamide
PubChem CID15732298
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC NameN-(5-hydroxypentyl)butanamide
SMILESCCCC(=O)NCCCCCO
InChIInChI=1S/C9H19NO2/c1-2-6-9(12)10-7-4-3-5-8-11/h11H,2-8H2,1H3,(H,10,12)
InChIKeyOIZZSONRYGZZGA-UHFFFAOYSA-N
XLogP1.07
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxypentyl)butanamide?
The IUPAC name of N-(5-hydroxypentyl)butanamide (CID 15732298) is N-(5-hydroxypentyl)butanamide.
What is the SMILES notation for N-(5-hydroxypentyl)butanamide?
The canonical SMILES for N-(5-hydroxypentyl)butanamide is CCCC(=O)NCCCCCO.
What is the InChIKey of N-(5-hydroxypentyl)butanamide?
The InChIKey is OIZZSONRYGZZGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-2-6-9(12)10-7-4-3-5-8-11/h11H,2-8H2,1H3,(H,10,12).
What are the key properties of N-(5-hydroxypentyl)butanamide?
N-(5-hydroxypentyl)butanamide has a molecular weight of 173.26 g/mol, XLogP of 1.07, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxypentyl)butanamide is sourced from PubChem (CID 15732298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).