2-cyclobutyl-3-fluorobenzamide

C11H12FNO — CID 89477243

IUPAC2-cyclobutyl-3-fluorobenzamide
SMILESNC(=O)c1cccc(F)c1C1CCC1
InChIInChI=1S/C11H12FNO/c12-9-6-2-5-8(11(13)14)10(9)7-3-1-4-7/h2,5-7H,1,3-4H2,(H2,13,14)
InChIKeyJCBNPLMFLDYLKL-UHFFFAOYSA-N
MW193.22 g/mol
LogP2.19
Rot. Bonds2

About 2-cyclobutyl-3-fluorobenzamide

2-cyclobutyl-3-fluorobenzamide (PubChem CID 89477243) has the molecular formula C11H12FNO and a molecular weight of 193.22 g/mol. Its IUPAC name is 2-cyclobutyl-3-fluorobenzamide.

Molecular Properties

Compound Name2-cyclobutyl-3-fluorobenzamide
PubChem CID89477243
Molecular FormulaC11H12FNO
Molecular Weight193.22 g/mol
Exact Mass193.09
IUPAC Name2-cyclobutyl-3-fluorobenzamide
SMILESNC(=O)c1cccc(F)c1C1CCC1
InChIInChI=1S/C11H12FNO/c12-9-6-2-5-8(11(13)14)10(9)7-3-1-4-7/h2,5-7H,1,3-4H2,(H2,13,14)
InChIKeyJCBNPLMFLDYLKL-UHFFFAOYSA-N
XLogP2.19
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-3-fluorobenzamide?
The IUPAC name of 2-cyclobutyl-3-fluorobenzamide (CID 89477243) is 2-cyclobutyl-3-fluorobenzamide.
What is the SMILES notation for 2-cyclobutyl-3-fluorobenzamide?
The canonical SMILES for 2-cyclobutyl-3-fluorobenzamide is NC(=O)c1cccc(F)c1C1CCC1.
What is the InChIKey of 2-cyclobutyl-3-fluorobenzamide?
The InChIKey is JCBNPLMFLDYLKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO/c12-9-6-2-5-8(11(13)14)10(9)7-3-1-4-7/h2,5-7H,1,3-4H2,(H2,13,14).
What are the key properties of 2-cyclobutyl-3-fluorobenzamide?
2-cyclobutyl-3-fluorobenzamide has a molecular weight of 193.22 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-3-fluorobenzamide is sourced from PubChem (CID 89477243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).