N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide

C11H13FN2O3 — CID 2876680

IUPACN'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide
SMILESCC(O)CNC(=O)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C11H13FN2O3/c1-7(15)6-13-10(16)11(17)14-9-4-2-8(12)3-5-9/h2-5,7,15H,6H2,1H3,(H,13,16)(H,14,17)
InChIKeyYMUILGYFCXBPGQ-UHFFFAOYSA-N
MW240.23 g/mol
LogP0.26
Rot. Bonds3

About N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide

N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide (PubChem CID 2876680) has the molecular formula C11H13FN2O3 and a molecular weight of 240.23 g/mol. Its IUPAC name is N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide.

Molecular Properties

Compound NameN'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide
PubChem CID2876680
Molecular FormulaC11H13FN2O3
Molecular Weight240.23 g/mol
Exact Mass240.09
IUPAC NameN'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide
SMILESCC(O)CNC(=O)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C11H13FN2O3/c1-7(15)6-13-10(16)11(17)14-9-4-2-8(12)3-5-9/h2-5,7,15H,6H2,1H3,(H,13,16)(H,14,17)
InChIKeyYMUILGYFCXBPGQ-UHFFFAOYSA-N
XLogP0.26
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.23
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide?
The IUPAC name of N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide (CID 2876680) is N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide.
What is the SMILES notation for N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide?
The canonical SMILES for N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide is CC(O)CNC(=O)C(=O)Nc1ccc(F)cc1.
What is the InChIKey of N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide?
The InChIKey is YMUILGYFCXBPGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O3/c1-7(15)6-13-10(16)11(17)14-9-4-2-8(12)3-5-9/h2-5,7,15H,6H2,1H3,(H,13,16)(H,14,17).
What are the key properties of N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide?
N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide has a molecular weight of 240.23 g/mol, XLogP of 0.26, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-fluorophenyl)-N-(2-hydroxypropyl)oxamide is sourced from PubChem (CID 2876680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).