2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide

C14H8ClF3N2O2 — CID 166842286

IUPAC2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide
SMILESO=CNc1ccc(Cl)c(C(=O)Nc2c(F)cc(F)cc2F)c1
InChIInChI=1S/C14H8ClF3N2O2/c15-10-2-1-8(19-6-21)5-9(10)14(22)20-13-11(17)3-7(16)4-12(13)18/h1-6H,(H,19,21)(H,20,22)
InChIKeyUDUKLDSMIZTGCC-UHFFFAOYSA-N
MW328.68 g/mol
LogP3.58
Rot. Bonds4

About 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide

2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide (PubChem CID 166842286) has the molecular formula C14H8ClF3N2O2 and a molecular weight of 328.68 g/mol. Its IUPAC name is 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide.

Molecular Properties

Compound Name2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide
PubChem CID166842286
Molecular FormulaC14H8ClF3N2O2
Molecular Weight328.68 g/mol
Exact Mass328.02
IUPAC Name2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide
SMILESO=CNc1ccc(Cl)c(C(=O)Nc2c(F)cc(F)cc2F)c1
InChIInChI=1S/C14H8ClF3N2O2/c15-10-2-1-8(19-6-21)5-9(10)14(22)20-13-11(17)3-7(16)4-12(13)18/h1-6H,(H,19,21)(H,20,22)
InChIKeyUDUKLDSMIZTGCC-UHFFFAOYSA-N
XLogP3.58
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.68
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide 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

2-chloro-5-sulfanyl-N-(2,4,6-trifluorophenyl)benzamide
CID 107031496
5-amino-2-chloro-N-(2-chloro-4,6-difluorophenyl)benzamide
CID 83080978
2-fluoro-N-(4-fluorophenyl)-5-formamidobenzamide
CID 166842297
2-chloro-5-[[(1S,3S)-2,2-dichloro-3-(3,5-dichlorophenyl)cyclopropanecarbonyl]amino]-N-(2,4,6-trifluorophenyl)benzamide
CID 122617537
2-chloro-N-[2,4-difluoro-5-(2-fluoropropanoylamino)-3-phosphanylphenyl]-5-formamidobenzamide
CID 134441715
N-(2-chloro-4,6-difluorophenyl)-2,3-difluorobenzamide
CID 82890016
N-(2,4,6-trifluorophenyl)formamide
CID 19027811
1,3-bis(2,4,6-trifluorophenyl)urea
CID 11716736
2,5-dichloro-N-(3-chloro-4-fluorophenyl)benzamide
CID 690469
4-amino-N-(2-bromo-4,6-difluorophenyl)-2-chlorobenzamide
CID 43168230
3-amino-2-chloro-N-(2-chloro-4,6-difluorophenyl)benzamide
CID 115930652
2-[(2,6-dichloro-4-fluorophenyl)carbamoyl]benzoic acid
CID 83078029

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide?
The IUPAC name of 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide (CID 166842286) is 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide.
What is the SMILES notation for 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide?
The canonical SMILES for 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide is O=CNc1ccc(Cl)c(C(=O)Nc2c(F)cc(F)cc2F)c1.
What is the InChIKey of 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide?
The InChIKey is UDUKLDSMIZTGCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8ClF3N2O2/c15-10-2-1-8(19-6-21)5-9(10)14(22)20-13-11(17)3-7(16)4-12(13)18/h1-6H,(H,19,21)(H,20,22).
What are the key properties of 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide?
2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide has a molecular weight of 328.68 g/mol, XLogP of 3.58, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-formamido-N-(2,4,6-trifluorophenyl)benzamide is sourced from PubChem (CID 166842286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).