2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide

C9H20N2O4 — CID 81088978

IUPAC2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide
SMILESCOCCOCCNC(=O)C(N)COC
InChIInChI=1S/C9H20N2O4/c1-13-5-6-15-4-3-11-9(12)8(10)7-14-2/h8H,3-7,10H2,1-2H3,(H,11,12)
InChIKeyYLFDXZOSARIITE-UHFFFAOYSA-N
MW220.27 g/mol
LogP-1.26
Rot. Bonds9

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

2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide (PubChem CID 81088978) has the molecular formula C9H20N2O4 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide.

Molecular Properties

Compound Name2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide
PubChem CID81088978
Molecular FormulaC9H20N2O4
Molecular Weight220.27 g/mol
Exact Mass220.14
IUPAC Name2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide
SMILESCOCCOCCNC(=O)C(N)COC
InChIInChI=1S/C9H20N2O4/c1-13-5-6-15-4-3-11-9(12)8(10)7-14-2/h8H,3-7,10H2,1-2H3,(H,11,12)
InChIKeyYLFDXZOSARIITE-UHFFFAOYSA-N
XLogP-1.26
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 5-1.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide
CID 81089376
(2S)-2-amino-N-[2-(2-methoxyethoxy)ethyl]butanamide
CID 79023015
(2R)-2-amino-N-[2-(2-methoxyethoxy)ethyl]-4-methylpentanamide
CID 104903353
(2R)-2-amino-N-[2-(2-methoxyethoxy)ethyl]propanamide
CID 78977070
4-amino-5-[2-(2-methoxyethoxy)ethylamino]-5-oxopentanoic acid
CID 64890122
(2S)-2,6-diamino-N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]hexanamide
CID 141222319
2-amino-N-[2-(2-hydroxyethoxy)ethyl]-4-methoxybutanamide
CID 62476612
(2S)-2-amino-N-[3-(2-methoxyethoxy)propyl]butanamide
CID 79023229
2-amino-3-hydroxy-N-(2-methoxyethyl)propanamide
CID 59658304
2-amino-3-methoxy-N-(2-methylprop-2-enyl)propanamide
CID 114617067
(2S)-2-amino-N-[2-[2-[2-[[(2S)-2-aminopropanoyl]amino]ethoxy]ethoxy]ethyl]propanamide
CID 15459454
tert-butyl 4-amino-5-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethylamino]-5-oxopentanoate
CID 175504926

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide?
The IUPAC name of 2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide (CID 81088978) is 2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide.
What is the SMILES notation for 2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide?
The canonical SMILES for 2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide is COCCOCCNC(=O)C(N)COC.
What is the InChIKey of 2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide?
The InChIKey is YLFDXZOSARIITE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O4/c1-13-5-6-15-4-3-11-9(12)8(10)7-14-2/h8H,3-7,10H2,1-2H3,(H,11,12).
What are the key properties of 2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide?
2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide has a molecular weight of 220.27 g/mol, XLogP of -1.26, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methoxy-N-[2-(2-methoxyethoxy)ethyl]propanamide is sourced from PubChem (CID 81088978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).