2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide

C8H15N3O4 — CID 177180356

IUPAC2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide
SMILESCNC(=O)C(C)OCNC(=O)CNC=O
InChIInChI=1S/C8H15N3O4/c1-6(8(14)9-2)15-5-11-7(13)3-10-4-12/h4,6H,3,5H2,1-2H3,(H,9,14)(H,10,12)(H,11,13)
InChIKeyHYILADKUOAIWNF-UHFFFAOYSA-N
MW217.22 g/mol
LogP-2.04
Rot. Bonds7

About 2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide

2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide (PubChem CID 177180356) has the molecular formula C8H15N3O4 and a molecular weight of 217.22 g/mol. Its IUPAC name is 2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide.

Molecular Properties

Compound Name2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide
PubChem CID177180356
Molecular FormulaC8H15N3O4
Molecular Weight217.22 g/mol
Exact Mass217.11
IUPAC Name2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide
SMILESCNC(=O)C(C)OCNC(=O)CNC=O
InChIInChI=1S/C8H15N3O4/c1-6(8(14)9-2)15-5-11-7(13)3-10-4-12/h4,6H,3,5H2,1-2H3,(H,9,14)(H,10,12)(H,11,13)
InChIKeyHYILADKUOAIWNF-UHFFFAOYSA-N
XLogP-2.04
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.22
LogP ≤ 5-2.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide?
The IUPAC name of 2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide (CID 177180356) is 2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide.
What is the SMILES notation for 2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide?
The canonical SMILES for 2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide is CNC(=O)C(C)OCNC(=O)CNC=O.
What is the InChIKey of 2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide?
The InChIKey is HYILADKUOAIWNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O4/c1-6(8(14)9-2)15-5-11-7(13)3-10-4-12/h4,6H,3,5H2,1-2H3,(H,9,14)(H,10,12)(H,11,13).
What are the key properties of 2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide?
2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide has a molecular weight of 217.22 g/mol, XLogP of -2.04, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2-formamidoacetyl)amino]methoxy]-N-methylpropanamide is sourced from PubChem (CID 177180356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).