3-amino-N-(2-methoxyethyl)propanamide

C6H14N2O2 — CID 16783560

IUPAC3-amino-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)CCN
InChIInChI=1S/C6H14N2O2/c1-10-5-4-8-6(9)2-3-7/h2-5,7H2,1H3,(H,8,9)
InChIKeyYGAGDVBSBLXYNT-UHFFFAOYSA-N
MW146.19 g/mol
LogP-0.90
Rot. Bonds5

About 3-amino-N-(2-methoxyethyl)propanamide

3-amino-N-(2-methoxyethyl)propanamide (PubChem CID 16783560) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 3-amino-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name3-amino-N-(2-methoxyethyl)propanamide
PubChem CID16783560
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name3-amino-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)CCN
InChIInChI=1S/C6H14N2O2/c1-10-5-4-8-6(9)2-3-7/h2-5,7H2,1H3,(H,8,9)
InChIKeyYGAGDVBSBLXYNT-UHFFFAOYSA-N
XLogP-0.90
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 5-0.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methoxyethyl)propanamide?
The IUPAC name of 3-amino-N-(2-methoxyethyl)propanamide (CID 16783560) is 3-amino-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 3-amino-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 3-amino-N-(2-methoxyethyl)propanamide is COCCNC(=O)CCN.
What is the InChIKey of 3-amino-N-(2-methoxyethyl)propanamide?
The InChIKey is YGAGDVBSBLXYNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-10-5-4-8-6(9)2-3-7/h2-5,7H2,1H3,(H,8,9).
What are the key properties of 3-amino-N-(2-methoxyethyl)propanamide?
3-amino-N-(2-methoxyethyl)propanamide has a molecular weight of 146.19 g/mol, XLogP of -0.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 16783560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).