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

C8H18N2O4 — CID 81089376

IUPAC2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide
SMILESCOCC(N)C(=O)NCCOCCO
InChIInChI=1S/C8H18N2O4/c1-13-6-7(9)8(12)10-2-4-14-5-3-11/h7,11H,2-6,9H2,1H3,(H,10,12)
InChIKeyTXOSKFRSXIGTFC-UHFFFAOYSA-N
MW206.24 g/mol
LogP-1.91
Rot. Bonds8

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

2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide (PubChem CID 81089376) has the molecular formula C8H18N2O4 and a molecular weight of 206.24 g/mol. Its IUPAC name is 2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide.

Molecular Properties

Compound Name2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide
PubChem CID81089376
Molecular FormulaC8H18N2O4
Molecular Weight206.24 g/mol
Exact Mass206.13
IUPAC Name2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide
SMILESCOCC(N)C(=O)NCCOCCO
InChIInChI=1S/C8H18N2O4/c1-13-6-7(9)8(12)10-2-4-14-5-3-11/h7,11H,2-6,9H2,1H3,(H,10,12)
InChIKeyTXOSKFRSXIGTFC-UHFFFAOYSA-N
XLogP-1.91
TPSA93.81 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 5-1.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide 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

2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide
CID 81088978
2-amino-N-[2-(2-hydroxyethoxy)ethyl]-4-methoxybutanamide
CID 62476612
2-amino-N-[2-(2-hydroxyethoxy)ethyl]butanamide
CID 61273537
2-amino-N-[2-(2-hydroxyethoxy)ethyl]-5-oxopentanamide
CID 135228994
2-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide
CID 61275223
(2R)-2-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide
CID 78973371
(2S)-2,5-diamino-N-[2-(2-hydroxyethoxy)ethyl]pentanamide
CID 89199743
2-amino-N-[2-(2-hydroxyethoxy)ethyl]pent-4-ynamide
CID 115563193
4-amino-5-[2-(2-hydroxyethoxy)ethylamino]-5-oxopentanoic acid
CID 64888561
(2S)-2-amino-N-[2-(2-methoxyethoxy)ethyl]butanamide
CID 79023015
(2R)-2-amino-N-[2-(2-methoxyethoxy)ethyl]-4-methylpentanamide
CID 104903353
(2S)-2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-phenylpropanamide
CID 61275037

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide?
The IUPAC name of 2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide (CID 81089376) is 2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide.
What is the SMILES notation for 2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide?
The canonical SMILES for 2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide is COCC(N)C(=O)NCCOCCO.
What is the InChIKey of 2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide?
The InChIKey is TXOSKFRSXIGTFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O4/c1-13-6-7(9)8(12)10-2-4-14-5-3-11/h7,11H,2-6,9H2,1H3,(H,10,12).
What are the key properties of 2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide?
2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide has a molecular weight of 206.24 g/mol, XLogP of -1.91, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide is sourced from PubChem (CID 81089376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).