2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide

C16H14Cl2N2O2 — CID 773825

IUPAC2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide
SMILESCC(NC(=O)c1ccccc1Cl)NC(=O)c1ccccc1Cl
InChIInChI=1S/C16H14Cl2N2O2/c1-10(19-15(21)11-6-2-4-8-13(11)17)20-16(22)12-7-3-5-9-14(12)18/h2-10H,1H3,(H,19,21)(H,20,22)
InChIKeyDTLAKZFVWJACHS-UHFFFAOYSA-N
MW337.21 g/mol
LogP3.50
Rot. Bonds4

About 2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide

2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide (PubChem CID 773825) has the molecular formula C16H14Cl2N2O2 and a molecular weight of 337.21 g/mol. Its IUPAC name is 2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide
PubChem CID773825
Molecular FormulaC16H14Cl2N2O2
Molecular Weight337.21 g/mol
Exact Mass336.04
IUPAC Name2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide
SMILESCC(NC(=O)c1ccccc1Cl)NC(=O)c1ccccc1Cl
InChIInChI=1S/C16H14Cl2N2O2/c1-10(19-15(21)11-6-2-4-8-13(11)17)20-16(22)12-7-3-5-9-14(12)18/h2-10H,1H3,(H,19,21)(H,20,22)
InChIKeyDTLAKZFVWJACHS-UHFFFAOYSA-N
XLogP3.50
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.21
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide?
The IUPAC name of 2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide (CID 773825) is 2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide.
What is the SMILES notation for 2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide?
The canonical SMILES for 2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide is CC(NC(=O)c1ccccc1Cl)NC(=O)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide?
The InChIKey is DTLAKZFVWJACHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O2/c1-10(19-15(21)11-6-2-4-8-13(11)17)20-16(22)12-7-3-5-9-14(12)18/h2-10H,1H3,(H,19,21)(H,20,22).
What are the key properties of 2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide?
2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide has a molecular weight of 337.21 g/mol, XLogP of 3.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[1-[(2-chlorobenzoyl)amino]ethyl]benzamide is sourced from PubChem (CID 773825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).