N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide

C15H12Cl2N2O3 — CID 19796862

IUPACN-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NC(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C15H12Cl2N2O3/c1-22-13-5-3-2-4-10(13)14(20)19-15(21)18-9-6-7-11(16)12(17)8-9/h2-8H,1H3,(H2,18,19,20,21)
InChIKeyCEFJEHNLOIAKJO-UHFFFAOYSA-N
MW339.18 g/mol
LogP3.96
Rot. Bonds3

About N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide

N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide (PubChem CID 19796862) has the molecular formula C15H12Cl2N2O3 and a molecular weight of 339.18 g/mol. Its IUPAC name is N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide
PubChem CID19796862
Molecular FormulaC15H12Cl2N2O3
Molecular Weight339.18 g/mol
Exact Mass338.02
IUPAC NameN-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NC(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C15H12Cl2N2O3/c1-22-13-5-3-2-4-10(13)14(20)19-15(21)18-9-6-7-11(16)12(17)8-9/h2-8H,1H3,(H2,18,19,20,21)
InChIKeyCEFJEHNLOIAKJO-UHFFFAOYSA-N
XLogP3.96
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.18
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide?
The IUPAC name of N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide (CID 19796862) is N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide.
What is the SMILES notation for N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide?
The canonical SMILES for N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide is COc1ccccc1C(=O)NC(=O)Nc1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide?
The InChIKey is CEFJEHNLOIAKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O3/c1-22-13-5-3-2-4-10(13)14(20)19-15(21)18-9-6-7-11(16)12(17)8-9/h2-8H,1H3,(H2,18,19,20,21).
What are the key properties of N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide?
N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide has a molecular weight of 339.18 g/mol, XLogP of 3.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,4-dichlorophenyl)carbamoyl]-2-methoxybenzamide is sourced from PubChem (CID 19796862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).