2-amino-N-(6-fluoro-3-pyridinyl)acetamide

C7H8FN3O — CID 103794912

IUPAC2-amino-N-(6-fluoro-3-pyridinyl)acetamide
SMILESNCC(=O)Nc1ccc(F)nc1
InChIInChI=1S/C7H8FN3O/c8-6-2-1-5(4-10-6)11-7(12)3-9/h1-2,4H,3,9H2,(H,11,12)
InChIKeyNHQQPSRLWDUOBN-UHFFFAOYSA-N
MW169.16 g/mol
LogP0.12
Rot. Bonds2

About 2-amino-N-(6-fluoro-3-pyridinyl)acetamide

2-amino-N-(6-fluoro-3-pyridinyl)acetamide (PubChem CID 103794912) has the molecular formula C7H8FN3O and a molecular weight of 169.16 g/mol. Its IUPAC name is 2-amino-N-(6-fluoro-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(6-fluoro-3-pyridinyl)acetamide
PubChem CID103794912
Molecular FormulaC7H8FN3O
Molecular Weight169.16 g/mol
Exact Mass169.07
IUPAC Name2-amino-N-(6-fluoro-3-pyridinyl)acetamide
SMILESNCC(=O)Nc1ccc(F)nc1
InChIInChI=1S/C7H8FN3O/c8-6-2-1-5(4-10-6)11-7(12)3-9/h1-2,4H,3,9H2,(H,11,12)
InChIKeyNHQQPSRLWDUOBN-UHFFFAOYSA-N
XLogP0.12
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.16
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(6-fluoro-3-pyridinyl)acetamide?
The IUPAC name of 2-amino-N-(6-fluoro-3-pyridinyl)acetamide (CID 103794912) is 2-amino-N-(6-fluoro-3-pyridinyl)acetamide.
What is the SMILES notation for 2-amino-N-(6-fluoro-3-pyridinyl)acetamide?
The canonical SMILES for 2-amino-N-(6-fluoro-3-pyridinyl)acetamide is NCC(=O)Nc1ccc(F)nc1.
What is the InChIKey of 2-amino-N-(6-fluoro-3-pyridinyl)acetamide?
The InChIKey is NHQQPSRLWDUOBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FN3O/c8-6-2-1-5(4-10-6)11-7(12)3-9/h1-2,4H,3,9H2,(H,11,12).
What are the key properties of 2-amino-N-(6-fluoro-3-pyridinyl)acetamide?
2-amino-N-(6-fluoro-3-pyridinyl)acetamide has a molecular weight of 169.16 g/mol, XLogP of 0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(6-fluoro-3-pyridinyl)acetamide is sourced from PubChem (CID 103794912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).