N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide

C11H9F4NO — CID 47081962

IUPACN-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(F)c(C(F)(F)F)c1)C1CC1
InChIInChI=1S/C11H9F4NO/c12-9-4-3-7(5-8(9)11(13,14)15)16-10(17)6-1-2-6/h3-6H,1-2H2,(H,16,17)
InChIKeyFXIFWNPGORSESG-UHFFFAOYSA-N
MW247.19 g/mol
LogP3.19
Rot. Bonds2

About N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide

N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide (PubChem CID 47081962) has the molecular formula C11H9F4NO and a molecular weight of 247.19 g/mol. Its IUPAC name is N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide
PubChem CID47081962
Molecular FormulaC11H9F4NO
Molecular Weight247.19 g/mol
Exact Mass247.06
IUPAC NameN-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(F)c(C(F)(F)F)c1)C1CC1
InChIInChI=1S/C11H9F4NO/c12-9-4-3-7(5-8(9)11(13,14)15)16-10(17)6-1-2-6/h3-6H,1-2H2,(H,16,17)
InChIKeyFXIFWNPGORSESG-UHFFFAOYSA-N
XLogP3.19
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.19
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclohexanecarboxamide
CID 30148120
3-amino-N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119709839
N-[4-chloro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide
CID 3121382
N-[4-iodo-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide
CID 163584041
ethane;(4S)-N-[4-fluoro-3-(trifluoromethyl)phenyl]-3-methylbicyclo[2.2.1]heptane-2-carboxamide
CID 177139380
benzene;[4-fluoro-3-(trifluoromethyl)phenyl]carbamic acid
CID 174945939
N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrrolidine-1-carboxamide
CID 47456948
N-(3-fluoro-4-hydroxyphenyl)cyclopropanecarboxamide
CID 64780100
N-[4-fluoro-3-(trifluoromethyl)phenyl]-2-methylpyrrolidine-3-carboxamide
CID 79388149
2-amino-4,4-difluoro-N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide
CID 163396148
N-[4-fluoro-3-(trifluoromethyl)phenyl]-3-methylpyrrolidine-2-carboxamide
CID 102779041
4-amino-N-(3,4-difluorophenyl)cyclohexane-1-carboxamide
CID 60847397

Frequently Asked Questions

What is the IUPAC name of N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide (CID 47081962) is N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide is O=C(Nc1ccc(F)c(C(F)(F)F)c1)C1CC1.
What is the InChIKey of N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide?
The InChIKey is FXIFWNPGORSESG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F4NO/c12-9-4-3-7(5-8(9)11(13,14)15)16-10(17)6-1-2-6/h3-6H,1-2H2,(H,16,17).
What are the key properties of N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide?
N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide has a molecular weight of 247.19 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 47081962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).