2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide

C14H9ClF3NO — CID 2064029

IUPAC2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1ccccc1Cl
InChIInChI=1S/C14H9ClF3NO/c15-12-4-2-1-3-11(12)13(20)19-10-7-5-9(6-8-10)14(16,17)18/h1-8H,(H,19,20)
InChIKeyQZHFACQDPCASSB-UHFFFAOYSA-N
MW299.68 g/mol
LogP4.61
Rot. Bonds2

About 2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide

2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide (PubChem CID 2064029) has the molecular formula C14H9ClF3NO and a molecular weight of 299.68 g/mol. Its IUPAC name is 2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
PubChem CID2064029
Molecular FormulaC14H9ClF3NO
Molecular Weight299.68 g/mol
Exact Mass299.03
IUPAC Name2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1ccccc1Cl
InChIInChI=1S/C14H9ClF3NO/c15-12-4-2-1-3-11(12)13(20)19-10-7-5-9(6-8-10)14(16,17)18/h1-8H,(H,19,20)
InChIKeyQZHFACQDPCASSB-UHFFFAOYSA-N
XLogP4.61
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.68
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide
CID 155920070
2-chloro-N'-[4-(trifluoromethyl)benzoyl]benzohydrazide
CID 35932014
4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
CID 134151897
2-chloro-N-(4-chlorophenyl)benzamide;4-chloro-N-(4-chlorophenyl)benzamide
CID 159735192
4-(benzenesulfonamido)-2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 92677411
2-chloro-N-(4-sulfanylphenyl)benzamide
CID 27137419
3-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 118113315
2-chloro-N-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]benzamide
CID 3609395
2-chloro-4-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2988054
2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide
CID 43508377
5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
CID 134146320
3-acetyl-4-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 147118620

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide (CID 2064029) is 2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide is O=C(Nc1ccc(C(F)(F)F)cc1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide?
The InChIKey is QZHFACQDPCASSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClF3NO/c15-12-4-2-1-3-11(12)13(20)19-10-7-5-9(6-8-10)14(16,17)18/h1-8H,(H,19,20).
What are the key properties of 2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide?
2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide has a molecular weight of 299.68 g/mol, XLogP of 4.61, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 2064029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).