N-cyclobutyl-2,4-difluorobenzamide

C11H11F2NO — CID 70247338

IUPACN-cyclobutyl-2,4-difluorobenzamide
SMILESO=C(NC1CCC1)c1ccc(F)cc1F
InChIInChI=1S/C11H11F2NO/c12-7-4-5-9(10(13)6-7)11(15)14-8-2-1-3-8/h4-6,8H,1-3H2,(H,14,15)
InChIKeyHXCPMEJIJUJRRO-UHFFFAOYSA-N
MW211.21 g/mol
LogP2.25
Rot. Bonds2

About N-cyclobutyl-2,4-difluorobenzamide

N-cyclobutyl-2,4-difluorobenzamide (PubChem CID 70247338) has the molecular formula C11H11F2NO and a molecular weight of 211.21 g/mol. Its IUPAC name is N-cyclobutyl-2,4-difluorobenzamide.

Molecular Properties

Compound NameN-cyclobutyl-2,4-difluorobenzamide
PubChem CID70247338
Molecular FormulaC11H11F2NO
Molecular Weight211.21 g/mol
Exact Mass211.08
IUPAC NameN-cyclobutyl-2,4-difluorobenzamide
SMILESO=C(NC1CCC1)c1ccc(F)cc1F
InChIInChI=1S/C11H11F2NO/c12-7-4-5-9(10(13)6-7)11(15)14-8-2-1-3-8/h4-6,8H,1-3H2,(H,14,15)
InChIKeyHXCPMEJIJUJRRO-UHFFFAOYSA-N
XLogP2.25
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.21
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-N-cyclopentyl-4-fluorobenzamide
CID 9209126
4-chloro-N-cycloheptyl-2-fluorobenzamide
CID 26002204
N-(2-aminocyclopentyl)-2,4-difluorobenzamide
CID 55169899
N-(1-ethylpiperidin-4-yl)-2,4-difluorobenzamide
CID 36811979
N-[4-(cyclopentylamino)-4-oxobutyl]-2,4-difluorobenzamide
CID 17487252
2-amino-N-cycloheptyl-4-fluorobenzamide
CID 55139018
2-bromo-N-cyclooctyl-4-fluorobenzamide
CID 24693747
N-[2-(cycloheptylamino)ethyl]-2,4-difluorobenzamide
CID 78960880
N-[2-(cycloheptylamino)ethyl]-2,4-difluorobenzamide;hydrochloride
CID 119620646
N-[(3aS,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-5-yl]-2,4-difluorobenzamide
CID 43603814
N-[1-(cyanomethyl)piperidin-4-yl]-2,4-difluorobenzamide
CID 63625204
N-[3-[2-(cyclopentylcarbamoyl)anilino]-3-oxopropyl]-2,4-difluorobenzamide
CID 30670029

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-2,4-difluorobenzamide?
The IUPAC name of N-cyclobutyl-2,4-difluorobenzamide (CID 70247338) is N-cyclobutyl-2,4-difluorobenzamide.
What is the SMILES notation for N-cyclobutyl-2,4-difluorobenzamide?
The canonical SMILES for N-cyclobutyl-2,4-difluorobenzamide is O=C(NC1CCC1)c1ccc(F)cc1F.
What is the InChIKey of N-cyclobutyl-2,4-difluorobenzamide?
The InChIKey is HXCPMEJIJUJRRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2NO/c12-7-4-5-9(10(13)6-7)11(15)14-8-2-1-3-8/h4-6,8H,1-3H2,(H,14,15).
What are the key properties of N-cyclobutyl-2,4-difluorobenzamide?
N-cyclobutyl-2,4-difluorobenzamide has a molecular weight of 211.21 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-2,4-difluorobenzamide is sourced from PubChem (CID 70247338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).