N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide

C18H15F4NO — CID 110445857

IUPACN-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide
SMILESO=C(NC1(c2ccc(F)cc2)CCC1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C18H15F4NO/c19-15-8-6-13(7-9-15)17(10-1-11-17)23-16(24)12-2-4-14(5-3-12)18(20,21)22/h2-9H,1,10-11H2,(H,23,24)
InChIKeyJJTUOIQYSVQZJU-UHFFFAOYSA-N
MW337.32 g/mol
LogP4.65
Rot. Bonds3

About N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide

N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide (PubChem CID 110445857) has the molecular formula C18H15F4NO and a molecular weight of 337.32 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide
PubChem CID110445857
Molecular FormulaC18H15F4NO
Molecular Weight337.32 g/mol
Exact Mass337.11
IUPAC NameN-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide
SMILESO=C(NC1(c2ccc(F)cc2)CCC1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C18H15F4NO/c19-15-8-6-13(7-9-15)17(10-1-11-17)23-16(24)12-2-4-14(5-3-12)18(20,21)22/h2-9H,1,10-11H2,(H,23,24)
InChIKeyJJTUOIQYSVQZJU-UHFFFAOYSA-N
XLogP4.65
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.32
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1-phenylcyclopropyl)-4-(trifluoromethyl)benzamide
CID 110445847
3,4-dichloro-N-[1-(4-fluorophenyl)cyclobutyl]benzamide
CID 110444172
N-[2-[[4-(4-fluorophenyl)oxan-4-yl]amino]-2-oxoethyl]-4-(trifluoromethyl)benzamide
CID 86898610
4-(aminomethyl)-N-[1-(4-fluorophenyl)cyclopentyl]benzamide;hydrochloride
CID 119305591
N-[1-(4-fluorophenyl)cyclobutyl]-2,3-dimethylquinoxaline-6-carboxamide
CID 71885526
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-4-(trifluoromethyl)benzamide
CID 42266020
N-[1-(4-fluorophenyl)cyclopropyl]-4-methoxybenzamide
CID 110440290
N-[1-(4-fluorophenyl)cyclobutyl]-3-methylbenzamide
CID 110441487
N-[1-(4-fluorophenyl)cyclopentyl]acetamide
CID 71936960
1-methyl-3-[1-[4-(trifluoromethyl)phenyl]cyclopropyl]urea
CID 110490845
N-[1-(4-fluorophenyl)cyclobutyl]cyclopropanecarboxamide
CID 47408173
N-[1-(4-fluorophenyl)cyclopropyl]-3,4-dimethylbenzamide
CID 113091009

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide?
The IUPAC name of N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide (CID 110445857) is N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide?
The canonical SMILES for N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide is O=C(NC1(c2ccc(F)cc2)CCC1)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide?
The InChIKey is JJTUOIQYSVQZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F4NO/c19-15-8-6-13(7-9-15)17(10-1-11-17)23-16(24)12-2-4-14(5-3-12)18(20,21)22/h2-9H,1,10-11H2,(H,23,24).
What are the key properties of N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide?
N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide has a molecular weight of 337.32 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)cyclobutyl]-4-(trifluoromethyl)benzamide is sourced from PubChem (CID 110445857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).