N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide

C15H10ClF5N2O — CID 35823651

IUPACN-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide
SMILESO=C(CNc1cc(F)cc(F)c1)Nc1ccc(Cl)cc1C(F)(F)F
InChIInChI=1S/C15H10ClF5N2O/c16-8-1-2-13(12(3-8)15(19,20)21)23-14(24)7-22-11-5-9(17)4-10(18)6-11/h1-6,22H,7H2,(H,23,24)
InChIKeyFYJOYTIHPMSBCR-UHFFFAOYSA-N
MW364.70 g/mol
LogP4.69
Rot. Bonds4

About N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide

N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide (PubChem CID 35823651) has the molecular formula C15H10ClF5N2O and a molecular weight of 364.70 g/mol. Its IUPAC name is N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide.

Molecular Properties

Compound NameN-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide
PubChem CID35823651
Molecular FormulaC15H10ClF5N2O
Molecular Weight364.70 g/mol
Exact Mass364.04
IUPAC NameN-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide
SMILESO=C(CNc1cc(F)cc(F)c1)Nc1ccc(Cl)cc1C(F)(F)F
InChIInChI=1S/C15H10ClF5N2O/c16-8-1-2-13(12(3-8)15(19,20)21)23-14(24)7-22-11-5-9(17)4-10(18)6-11/h1-6,22H,7H2,(H,23,24)
InChIKeyFYJOYTIHPMSBCR-UHFFFAOYSA-N
XLogP4.69
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.70
LogP ≤ 54.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide?
The IUPAC name of N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide (CID 35823651) is N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide.
What is the SMILES notation for N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide?
The canonical SMILES for N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide is O=C(CNc1cc(F)cc(F)c1)Nc1ccc(Cl)cc1C(F)(F)F.
What is the InChIKey of N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide?
The InChIKey is FYJOYTIHPMSBCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClF5N2O/c16-8-1-2-13(12(3-8)15(19,20)21)23-14(24)7-22-11-5-9(17)4-10(18)6-11/h1-6,22H,7H2,(H,23,24).
What are the key properties of N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide?
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide has a molecular weight of 364.70 g/mol, XLogP of 4.69, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(3,5-difluoroanilino)acetamide is sourced from PubChem (CID 35823651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).