N,N-diethyl-4-hydroxybutanamide

C8H17NO2 — CID 13088423

IUPACN,N-diethyl-4-hydroxybutanamide
SMILESCCN(CC)C(=O)CCCO
InChIInChI=1S/C8H17NO2/c1-3-9(4-2)8(11)6-5-7-10/h10H,3-7H2,1-2H3
InChIKeyZHNJBWWVKJGQGF-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.63
Rot. Bonds5

About N,N-diethyl-4-hydroxybutanamide

N,N-diethyl-4-hydroxybutanamide (PubChem CID 13088423) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is N,N-diethyl-4-hydroxybutanamide.

Molecular Properties

Compound NameN,N-diethyl-4-hydroxybutanamide
PubChem CID13088423
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC NameN,N-diethyl-4-hydroxybutanamide
SMILESCCN(CC)C(=O)CCCO
InChIInChI=1S/C8H17NO2/c1-3-9(4-2)8(11)6-5-7-10/h10H,3-7H2,1-2H3
InChIKeyZHNJBWWVKJGQGF-UHFFFAOYSA-N
XLogP0.63
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,N-diethyl-4-hydroxybutanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-hydroxybutanamide?
The IUPAC name of N,N-diethyl-4-hydroxybutanamide (CID 13088423) is N,N-diethyl-4-hydroxybutanamide.
What is the SMILES notation for N,N-diethyl-4-hydroxybutanamide?
The canonical SMILES for N,N-diethyl-4-hydroxybutanamide is CCN(CC)C(=O)CCCO.
What is the InChIKey of N,N-diethyl-4-hydroxybutanamide?
The InChIKey is ZHNJBWWVKJGQGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-3-9(4-2)8(11)6-5-7-10/h10H,3-7H2,1-2H3.
What are the key properties of N,N-diethyl-4-hydroxybutanamide?
N,N-diethyl-4-hydroxybutanamide has a molecular weight of 159.23 g/mol, XLogP of 0.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-hydroxybutanamide is sourced from PubChem (CID 13088423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).