N-(4-anilinophenyl)-2,6-dichlorobenzamide

C19H14Cl2N2O — CID 1001634

IUPACN-(4-anilinophenyl)-2,6-dichlorobenzamide
SMILESO=C(Nc1ccc(Nc2ccccc2)cc1)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H14Cl2N2O/c20-16-7-4-8-17(21)18(16)19(24)23-15-11-9-14(10-12-15)22-13-5-2-1-3-6-13/h1-12,22H,(H,23,24)
InChIKeyGWSFRLMLGQGHNM-UHFFFAOYSA-N
MW357.24 g/mol
LogP5.99
Rot. Bonds4

About N-(4-anilinophenyl)-2,6-dichlorobenzamide

N-(4-anilinophenyl)-2,6-dichlorobenzamide (PubChem CID 1001634) has the molecular formula C19H14Cl2N2O and a molecular weight of 357.24 g/mol. Its IUPAC name is N-(4-anilinophenyl)-2,6-dichlorobenzamide.

Molecular Properties

Compound NameN-(4-anilinophenyl)-2,6-dichlorobenzamide
PubChem CID1001634
Molecular FormulaC19H14Cl2N2O
Molecular Weight357.24 g/mol
Exact Mass356.05
IUPAC NameN-(4-anilinophenyl)-2,6-dichlorobenzamide
SMILESO=C(Nc1ccc(Nc2ccccc2)cc1)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H14Cl2N2O/c20-16-7-4-8-17(21)18(16)19(24)23-15-11-9-14(10-12-15)22-13-5-2-1-3-6-13/h1-12,22H,(H,23,24)
InChIKeyGWSFRLMLGQGHNM-UHFFFAOYSA-N
XLogP5.99
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.24
LogP ≤ 55.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-anilinophenyl)-2,6-dichlorobenzamide?
The IUPAC name of N-(4-anilinophenyl)-2,6-dichlorobenzamide (CID 1001634) is N-(4-anilinophenyl)-2,6-dichlorobenzamide.
What is the SMILES notation for N-(4-anilinophenyl)-2,6-dichlorobenzamide?
The canonical SMILES for N-(4-anilinophenyl)-2,6-dichlorobenzamide is O=C(Nc1ccc(Nc2ccccc2)cc1)c1c(Cl)cccc1Cl.
What is the InChIKey of N-(4-anilinophenyl)-2,6-dichlorobenzamide?
The InChIKey is GWSFRLMLGQGHNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2N2O/c20-16-7-4-8-17(21)18(16)19(24)23-15-11-9-14(10-12-15)22-13-5-2-1-3-6-13/h1-12,22H,(H,23,24).
What are the key properties of N-(4-anilinophenyl)-2,6-dichlorobenzamide?
N-(4-anilinophenyl)-2,6-dichlorobenzamide has a molecular weight of 357.24 g/mol, XLogP of 5.99, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilinophenyl)-2,6-dichlorobenzamide is sourced from PubChem (CID 1001634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).