3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide

C16H14Cl2N2O2 — CID 17397210

IUPAC3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide
SMILESCC(=O)Nc1cccc(C(=O)NCc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C16H14Cl2N2O2/c1-10(21)20-14-4-2-3-11(7-14)16(22)19-9-12-5-6-13(17)8-15(12)18/h2-8H,9H2,1H3,(H,19,22)(H,20,21)
InChIKeyFNQZAMMEZBBZDS-UHFFFAOYSA-N
MW337.21 g/mol
LogP3.88
Rot. Bonds4

About 3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide

3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide (PubChem CID 17397210) has the molecular formula C16H14Cl2N2O2 and a molecular weight of 337.21 g/mol. Its IUPAC name is 3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide.

Molecular Properties

Compound Name3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide
PubChem CID17397210
Molecular FormulaC16H14Cl2N2O2
Molecular Weight337.21 g/mol
Exact Mass336.04
IUPAC Name3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide
SMILESCC(=O)Nc1cccc(C(=O)NCc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C16H14Cl2N2O2/c1-10(21)20-14-4-2-3-11(7-14)16(22)19-9-12-5-6-13(17)8-15(12)18/h2-8H,9H2,1H3,(H,19,22)(H,20,21)
InChIKeyFNQZAMMEZBBZDS-UHFFFAOYSA-N
XLogP3.88
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 ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-acetamidophenyl)-2-(2,4-dichlorophenyl)acetamide
CID 7914502
3-acetamido-N-[(2-fluorophenyl)methyl]benzamide
CID 8012881
ethyl 3-[(2,4-dichlorophenyl)methylcarbamoylamino]benzoate
CID 3759003
N-[3-[2-(2,4-dichlorophenyl)ethylcarbamoylamino]phenyl]acetamide
CID 108991040
3-acetamido-N-ethylbenzamide
CID 17230670
N-(3-acetylphenyl)-3-(2,4-dichlorophenyl)propanamide
CID 100606597
N'-(3-acetylphenyl)-N-[2-(2,4-dichlorophenyl)ethyl]oxamide
CID 108986646
N-(3-acetamidophenyl)-3-chlorobenzamide
CID 669190
methyl 3-[(2,4-dichlorophenyl)methylamino]benzoate
CID 43217500
3-acetamido-N-[(3-bromophenyl)methyl]benzamide
CID 127116055
3-acetamido-N-[(5-fluoro-2-methoxyphenyl)methyl]benzamide
CID 110793473
3-acetamido-N-[[1-(3-chlorophenyl)cyclopropyl]methyl]benzamide
CID 110439910

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide?
The IUPAC name of 3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide (CID 17397210) is 3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide.
What is the SMILES notation for 3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide?
The canonical SMILES for 3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide is CC(=O)Nc1cccc(C(=O)NCc2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide?
The InChIKey is FNQZAMMEZBBZDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O2/c1-10(21)20-14-4-2-3-11(7-14)16(22)19-9-12-5-6-13(17)8-15(12)18/h2-8H,9H2,1H3,(H,19,22)(H,20,21).
What are the key properties of 3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide?
3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide has a molecular weight of 337.21 g/mol, XLogP of 3.88, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-[(2,4-dichlorophenyl)methyl]benzamide is sourced from PubChem (CID 17397210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).