(3R)-N-butyl-3-hydroxypentanamide

C9H19NO2 — CID 135071072

IUPAC(3R)-N-butyl-3-hydroxypentanamide
SMILESCCCCNC(=O)C[C@H](O)CC
InChIInChI=1S/C9H19NO2/c1-3-5-6-10-9(12)7-8(11)4-2/h8,11H,3-7H2,1-2H3,(H,10,12)/t8-/m1/s1
InChIKeyYHPLNYYOMRWUOE-MRVPVSSYSA-N
MW173.26 g/mol
LogP1.06
Rot. Bonds6

About (3R)-N-butyl-3-hydroxypentanamide

(3R)-N-butyl-3-hydroxypentanamide (PubChem CID 135071072) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is (3R)-N-butyl-3-hydroxypentanamide.

Molecular Properties

Compound Name(3R)-N-butyl-3-hydroxypentanamide
PubChem CID135071072
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name(3R)-N-butyl-3-hydroxypentanamide
SMILESCCCCNC(=O)C[C@H](O)CC
InChIInChI=1S/C9H19NO2/c1-3-5-6-10-9(12)7-8(11)4-2/h8,11H,3-7H2,1-2H3,(H,10,12)/t8-/m1/s1
InChIKeyYHPLNYYOMRWUOE-MRVPVSSYSA-N
XLogP1.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (3R)-N-butyl-3-hydroxypentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Butoctamide
CID 65780
4-hydroxy-2-Piperidinone
CID 11251988
(4R)-4-Hydroxypiperidin-2-one
CID 25419160
Hexanamide, N-(2-hydroxypropyl)-
CID 90875
(4S)-4-hydroxypiperidin-2-one
CID 11815843
N-ethyl-3-hydroxybutanamide
CID 14195430
(3R)-3-hydroxy-N-prop-2-enylpentanamide
CID 135081115
N-cyclohexyl-3-hydroxybutanamide
CID 69602939
n-(3-Hydroxypropyl)hexanamide
CID 110346
6-fluoro-N-(3-hydroxyhexyl)hexanamide
CID 168158661
N-butyl-4-hydroxypentanamide
CID 79001558
3-hydroxy-N-(hydroxymethyl)pentanamide
CID 123152534

Frequently Asked Questions

What is the IUPAC name of (3R)-N-butyl-3-hydroxypentanamide?
The IUPAC name of (3R)-N-butyl-3-hydroxypentanamide (CID 135071072) is (3R)-N-butyl-3-hydroxypentanamide.
What is the SMILES notation for (3R)-N-butyl-3-hydroxypentanamide?
The canonical SMILES for (3R)-N-butyl-3-hydroxypentanamide is CCCCNC(=O)C[C@H](O)CC.
What is the InChIKey of (3R)-N-butyl-3-hydroxypentanamide?
The InChIKey is YHPLNYYOMRWUOE-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-3-5-6-10-9(12)7-8(11)4-2/h8,11H,3-7H2,1-2H3,(H,10,12)/t8-/m1/s1.
What are the key properties of (3R)-N-butyl-3-hydroxypentanamide?
(3R)-N-butyl-3-hydroxypentanamide has a molecular weight of 173.26 g/mol, XLogP of 1.06, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-butyl-3-hydroxypentanamide is sourced from PubChem (CID 135071072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).