N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide

C8H16N2O3 — CID 103104212

IUPACN-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide
SMILESCCN(CC(N)=O)C(=O)CCCO
InChIInChI=1S/C8H16N2O3/c1-2-10(6-7(9)12)8(13)4-3-5-11/h11H,2-6H2,1H3,(H2,9,12)
InChIKeyRKCHDBVHRJWEER-UHFFFAOYSA-N
MW188.23 g/mol
LogP-0.91
Rot. Bonds6

About N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide

N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide (PubChem CID 103104212) has the molecular formula C8H16N2O3 and a molecular weight of 188.23 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide
PubChem CID103104212
Molecular FormulaC8H16N2O3
Molecular Weight188.23 g/mol
Exact Mass188.12
IUPAC NameN-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide
SMILESCCN(CC(N)=O)C(=O)CCCO
InChIInChI=1S/C8H16N2O3/c1-2-10(6-7(9)12)8(13)4-3-5-11/h11H,2-6H2,1H3,(H2,9,12)
InChIKeyRKCHDBVHRJWEER-UHFFFAOYSA-N
XLogP-0.91
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide (CID 103104212) is N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide is CCN(CC(N)=O)C(=O)CCCO.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide?
The InChIKey is RKCHDBVHRJWEER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O3/c1-2-10(6-7(9)12)8(13)4-3-5-11/h11H,2-6H2,1H3,(H2,9,12).
What are the key properties of N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide?
N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide has a molecular weight of 188.23 g/mol, XLogP of -0.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide is sourced from PubChem (CID 103104212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).