3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide

C7H16N2O3 — CID 61274475

IUPAC3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide
SMILESNCCC(=O)NCCOCCO
InChIInChI=1S/C7H16N2O3/c8-2-1-7(11)9-3-5-12-6-4-10/h10H,1-6,8H2,(H,9,11)
InChIKeyGQYQBCNOJWXMAG-UHFFFAOYSA-N
MW176.22 g/mol
LogP-1.54
Rot. Bonds7

About 3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide

3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide (PubChem CID 61274475) has the molecular formula C7H16N2O3 and a molecular weight of 176.22 g/mol. Its IUPAC name is 3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide.

Molecular Properties

Compound Name3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide
PubChem CID61274475
Molecular FormulaC7H16N2O3
Molecular Weight176.22 g/mol
Exact Mass176.12
IUPAC Name3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide
SMILESNCCC(=O)NCCOCCO
InChIInChI=1S/C7H16N2O3/c8-2-1-7(11)9-3-5-12-6-4-10/h10H,1-6,8H2,(H,9,11)
InChIKeyGQYQBCNOJWXMAG-UHFFFAOYSA-N
XLogP-1.54
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 5-1.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-[2-(2,2,2-trifluoroethoxy)ethyl]propanamide
CID 63828602
2-amino-N-[2-[2-(2-hydroxyethoxy)ethylamino]-2-oxoethyl]acetamide
CID 61274286
3-[2-amino-3-[3-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2-[[3-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethylamino]-3-oxopropoxy]methyl]propoxy]-N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]propanamide
CID 163953950
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-9-hydroxynonanamide
CID 155740106
7-amino-N-[3-(2-hydroxyethoxy)propyl]heptanamide
CID 106310658
N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pentanamide
CID 54534992
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]pentanamide
CID 175944386
N-[2-(2-hydroxyethoxy)ethyl]-3-[2-[2-[2-[2-(3-oxobutoxy)ethoxy]ethoxy]ethoxy]ethoxy]propanamide
CID 88581795
3-amino-N-[2-(2-methylprop-2-enoxy)ethyl]propanamide
CID 114467833
tert-butyl N-[2-[2-[2-(3-aminopropanoylamino)ethoxy]ethoxy]ethyl]carbamate
CID 166726831
2-(2-aminoethoxy)ethanol;decanoic acid;N-[2-(2-hydroxyethoxy)ethyl]decanamide
CID 166636671
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide
CID 131982939

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide?
The IUPAC name of 3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide (CID 61274475) is 3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide.
What is the SMILES notation for 3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide?
The canonical SMILES for 3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide is NCCC(=O)NCCOCCO.
What is the InChIKey of 3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide?
The InChIKey is GQYQBCNOJWXMAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O3/c8-2-1-7(11)9-3-5-12-6-4-10/h10H,1-6,8H2,(H,9,11).
What are the key properties of 3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide?
3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide has a molecular weight of 176.22 g/mol, XLogP of -1.54, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide is sourced from PubChem (CID 61274475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).