2-(furan-2-yl)-2-(methoxyamino)propanamide

C8H12N2O3 — CID 142650613

IUPAC2-(furan-2-yl)-2-(methoxyamino)propanamide
SMILESCONC(C)(C(N)=O)c1ccco1
InChIInChI=1S/C8H12N2O3/c1-8(7(9)11,10-12-2)6-4-3-5-13-6/h3-5,10H,1-2H3,(H2,9,11)
InChIKeySSEGOZQHGVTRHE-UHFFFAOYSA-N
MW184.20 g/mol
LogP0.13
Rot. Bonds4

About 2-(furan-2-yl)-2-(methoxyamino)propanamide

2-(furan-2-yl)-2-(methoxyamino)propanamide (PubChem CID 142650613) has the molecular formula C8H12N2O3 and a molecular weight of 184.20 g/mol. Its IUPAC name is 2-(furan-2-yl)-2-(methoxyamino)propanamide.

Molecular Properties

Compound Name2-(furan-2-yl)-2-(methoxyamino)propanamide
PubChem CID142650613
Molecular FormulaC8H12N2O3
Molecular Weight184.20 g/mol
Exact Mass184.08
IUPAC Name2-(furan-2-yl)-2-(methoxyamino)propanamide
SMILESCONC(C)(C(N)=O)c1ccco1
InChIInChI=1S/C8H12N2O3/c1-8(7(9)11,10-12-2)6-4-3-5-13-6/h3-5,10H,1-2H3,(H2,9,11)
InChIKeySSEGOZQHGVTRHE-UHFFFAOYSA-N
XLogP0.13
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-2-(methoxyamino)propanamide?
The IUPAC name of 2-(furan-2-yl)-2-(methoxyamino)propanamide (CID 142650613) is 2-(furan-2-yl)-2-(methoxyamino)propanamide.
What is the SMILES notation for 2-(furan-2-yl)-2-(methoxyamino)propanamide?
The canonical SMILES for 2-(furan-2-yl)-2-(methoxyamino)propanamide is CONC(C)(C(N)=O)c1ccco1.
What is the InChIKey of 2-(furan-2-yl)-2-(methoxyamino)propanamide?
The InChIKey is SSEGOZQHGVTRHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3/c1-8(7(9)11,10-12-2)6-4-3-5-13-6/h3-5,10H,1-2H3,(H2,9,11).
What are the key properties of 2-(furan-2-yl)-2-(methoxyamino)propanamide?
2-(furan-2-yl)-2-(methoxyamino)propanamide has a molecular weight of 184.20 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-2-(methoxyamino)propanamide is sourced from PubChem (CID 142650613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).