N-(2-acetamidoethyl)-5-hydroxypentanamide

C9H18N2O3 — CID 79199978

IUPACN-(2-acetamidoethyl)-5-hydroxypentanamide
SMILESCC(=O)NCCNC(=O)CCCCO
InChIInChI=1S/C9H18N2O3/c1-8(13)10-5-6-11-9(14)4-2-3-7-12/h12H,2-7H2,1H3,(H,10,13)(H,11,14)
InChIKeyXHOYMHHVZQALBQ-UHFFFAOYSA-N
MW202.25 g/mol
LogP-0.60
Rot. Bonds7

About N-(2-acetamidoethyl)-5-hydroxypentanamide

N-(2-acetamidoethyl)-5-hydroxypentanamide (PubChem CID 79199978) has the molecular formula C9H18N2O3 and a molecular weight of 202.25 g/mol. Its IUPAC name is N-(2-acetamidoethyl)-5-hydroxypentanamide.

Molecular Properties

Compound NameN-(2-acetamidoethyl)-5-hydroxypentanamide
PubChem CID79199978
Molecular FormulaC9H18N2O3
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC NameN-(2-acetamidoethyl)-5-hydroxypentanamide
SMILESCC(=O)NCCNC(=O)CCCCO
InChIInChI=1S/C9H18N2O3/c1-8(13)10-5-6-11-9(14)4-2-3-7-12/h12H,2-7H2,1H3,(H,10,13)(H,11,14)
InChIKeyXHOYMHHVZQALBQ-UHFFFAOYSA-N
XLogP-0.60
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 5-0.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-acetamidoethyl)-5-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

4-hydroxy-N-[2-(4-hydroxybutanoylamino)ethyl]butanamide
CID 95562402
5-hydroxy-N-[3-(methylamino)-3-oxopropyl]pentanamide
CID 79209725
5-acetamido-N-butylpentanamide
CID 123729472
6-acetamido-N-propylhexanamide
CID 60654879
6-hydroxy-N-tetradecylhexanamide
CID 20542961
18-hydroxy-N-octadecyloctadecanamide
CID 10984479
N-butyl-6-hydroxyhexanamide;ethane
CID 145076581
5-hydroxy-N-(2-methylsulfanylethyl)pentanamide
CID 79198659
6-[6-(6-acetamidohexanoylamino)hexanoylamino]hexanoic acid
CID 59079185
5-acetamido-N-ethylpentanamide
CID 145189248
N'-(2-acetamidoethyl)-N-(5-hydroxypentyl)oxamide
CID 108525833
4-acetamido-N-[4-oxo-4-[[4-oxo-4-[[4-oxo-4-(propylamino)butyl]amino]butyl]amino]butyl]butanamide
CID 71430120

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamidoethyl)-5-hydroxypentanamide?
The IUPAC name of N-(2-acetamidoethyl)-5-hydroxypentanamide (CID 79199978) is N-(2-acetamidoethyl)-5-hydroxypentanamide.
What is the SMILES notation for N-(2-acetamidoethyl)-5-hydroxypentanamide?
The canonical SMILES for N-(2-acetamidoethyl)-5-hydroxypentanamide is CC(=O)NCCNC(=O)CCCCO.
What is the InChIKey of N-(2-acetamidoethyl)-5-hydroxypentanamide?
The InChIKey is XHOYMHHVZQALBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3/c1-8(13)10-5-6-11-9(14)4-2-3-7-12/h12H,2-7H2,1H3,(H,10,13)(H,11,14).
What are the key properties of N-(2-acetamidoethyl)-5-hydroxypentanamide?
N-(2-acetamidoethyl)-5-hydroxypentanamide has a molecular weight of 202.25 g/mol, XLogP of -0.60, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamidoethyl)-5-hydroxypentanamide is sourced from PubChem (CID 79199978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).