2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide

C8H13FN2O3 — CID 146334335

IUPAC2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide
SMILESCC(F)C(=O)N(C(=O)NC=O)C(C)C
InChIInChI=1S/C8H13FN2O3/c1-5(2)11(7(13)6(3)9)8(14)10-4-12/h4-6H,1-3H3,(H,10,12,14)
InChIKeyTZDXNAJRDJGECE-UHFFFAOYSA-N
MW204.20 g/mol
LogP0.45
Rot. Bonds3

About 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide

2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide (PubChem CID 146334335) has the molecular formula C8H13FN2O3 and a molecular weight of 204.20 g/mol. Its IUPAC name is 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide
PubChem CID146334335
Molecular FormulaC8H13FN2O3
Molecular Weight204.20 g/mol
Exact Mass204.09
IUPAC Name2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide
SMILESCC(F)C(=O)N(C(=O)NC=O)C(C)C
InChIInChI=1S/C8H13FN2O3/c1-5(2)11(7(13)6(3)9)8(14)10-4-12/h4-6H,1-3H3,(H,10,12,14)
InChIKeyTZDXNAJRDJGECE-UHFFFAOYSA-N
XLogP0.45
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.20
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide?
The IUPAC name of 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide (CID 146334335) is 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide?
The canonical SMILES for 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide is CC(F)C(=O)N(C(=O)NC=O)C(C)C.
What is the InChIKey of 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide?
The InChIKey is TZDXNAJRDJGECE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13FN2O3/c1-5(2)11(7(13)6(3)9)8(14)10-4-12/h4-6H,1-3H3,(H,10,12,14).
What are the key properties of 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide?
2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide has a molecular weight of 204.20 g/mol, XLogP of 0.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(formylcarbamoyl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 146334335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).