CID 59324294

C10H17FN2O3 — CID 59324294

IUPAC—
SMILES[CH]C(CCOCC(C)C(=O)NF)C(=O)NC
InChIInChI=1S/C10H17FN2O3/c1-7(9(14)12-3)4-5-16-6-8(2)10(15)13-11/h1,7-8H,4-6H2,2-3H3,(H,12,14)(H,13,15)
InChIKeyZCZAIBHYDVPGDQ-UHFFFAOYSA-N
MW232.25 g/mol
LogP0.10
Rot. Bonds7

About CID 59324294

CID 59324294 (PubChem CID 59324294) has the molecular formula C10H17FN2O3 and a molecular weight of 232.25 g/mol.

Molecular Properties

Compound NameCID 59324294
PubChem CID59324294
Molecular FormulaC10H17FN2O3
Molecular Weight232.25 g/mol
Exact Mass232.12
IUPAC Name—
SMILES[CH]C(CCOCC(C)C(=O)NF)C(=O)NC
InChIInChI=1S/C10H17FN2O3/c1-7(9(14)12-3)4-5-16-6-8(2)10(15)13-11/h1,7-8H,4-6H2,2-3H3,(H,12,14)(H,13,15)
InChIKeyZCZAIBHYDVPGDQ-UHFFFAOYSA-N
XLogP0.10
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 59324294?
The IUPAC name of CID 59324294 (CID 59324294) is not available.
What is the SMILES notation for CID 59324294?
The canonical SMILES for CID 59324294 is [CH]C(CCOCC(C)C(=O)NF)C(=O)NC.
What is the InChIKey of CID 59324294?
The InChIKey is ZCZAIBHYDVPGDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17FN2O3/c1-7(9(14)12-3)4-5-16-6-8(2)10(15)13-11/h1,7-8H,4-6H2,2-3H3,(H,12,14)(H,13,15).
What are the key properties of CID 59324294?
CID 59324294 has a molecular weight of 232.25 g/mol, XLogP of 0.10, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59324294 is sourced from PubChem (CID 59324294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).