2,4,6-trichloro-N-phenylbenzamide

C13H8Cl3NO — CID 68933625

IUPAC2,4,6-trichloro-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C13H8Cl3NO/c14-8-6-10(15)12(11(16)7-8)13(18)17-9-4-2-1-3-5-9/h1-7H,(H,17,18)
InChIKeyUBOHMMUSDIXLPV-UHFFFAOYSA-N
MW300.57 g/mol
LogP4.90
Rot. Bonds2

About 2,4,6-trichloro-N-phenylbenzamide

2,4,6-trichloro-N-phenylbenzamide (PubChem CID 68933625) has the molecular formula C13H8Cl3NO and a molecular weight of 300.57 g/mol. Its IUPAC name is 2,4,6-trichloro-N-phenylbenzamide.

Molecular Properties

Compound Name2,4,6-trichloro-N-phenylbenzamide
PubChem CID68933625
Molecular FormulaC13H8Cl3NO
Molecular Weight300.57 g/mol
Exact Mass298.97
IUPAC Name2,4,6-trichloro-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C13H8Cl3NO/c14-8-6-10(15)12(11(16)7-8)13(18)17-9-4-2-1-3-5-9/h1-7H,(H,17,18)
InChIKeyUBOHMMUSDIXLPV-UHFFFAOYSA-N
XLogP4.90
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.57
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-amino-4,6-dichloro-N-phenylbenzamide
CID 15314627
N-phenyl-5-[(2,4,6-trichlorobenzoyl)amino]-1,3-thiazole-4-carboxamide
CID 11690446
N-(4-anilinophenyl)-3,5-dichlorobenzamide
CID 17133461
2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide
CID 3386476
3,5-dichloro-N-[3-(phenylcarbamoylamino)phenyl]benzamide
CID 10971378
2,3,4,5,6-pentamethyl-N-phenylbenzamide
CID 60629319
N-(3,5-dichlorophenyl)-2,6-dihydroxybenzamide
CID 107688954
3-amino-6-chloro-2-methyl-N-phenylbenzamide
CID 86676286
1-[(2,6-dichlorobenzoyl)amino]-3-phenylurea
CID 134118825
3,5-dichloro-N-[2-(phenylcarbamoyl)phenyl]benzamide
CID 17133465
2,6-dichloro-N-(3,4-difluorophenyl)benzamide
CID 4128288
2,6-dichloro-N-(4-methylphenyl)benzamide
CID 5152296

Frequently Asked Questions

What is the IUPAC name of 2,4,6-trichloro-N-phenylbenzamide?
The IUPAC name of 2,4,6-trichloro-N-phenylbenzamide (CID 68933625) is 2,4,6-trichloro-N-phenylbenzamide.
What is the SMILES notation for 2,4,6-trichloro-N-phenylbenzamide?
The canonical SMILES for 2,4,6-trichloro-N-phenylbenzamide is O=C(Nc1ccccc1)c1c(Cl)cc(Cl)cc1Cl.
What is the InChIKey of 2,4,6-trichloro-N-phenylbenzamide?
The InChIKey is UBOHMMUSDIXLPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl3NO/c14-8-6-10(15)12(11(16)7-8)13(18)17-9-4-2-1-3-5-9/h1-7H,(H,17,18).
What are the key properties of 2,4,6-trichloro-N-phenylbenzamide?
2,4,6-trichloro-N-phenylbenzamide has a molecular weight of 300.57 g/mol, XLogP of 4.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trichloro-N-phenylbenzamide is sourced from PubChem (CID 68933625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).