2-[(2-ethylsulfanylbenzoyl)amino]benzamide

C16H16N2O2S — CID 4631713

IUPAC2-[(2-ethylsulfanylbenzoyl)amino]benzamide
SMILESCCSc1ccccc1C(=O)Nc1ccccc1C(N)=O
InChIInChI=1S/C16H16N2O2S/c1-2-21-14-10-6-4-8-12(14)16(20)18-13-9-5-3-7-11(13)15(17)19/h3-10H,2H2,1H3,(H2,17,19)(H,18,20)
InChIKeyXOPJBQUPCRNZKU-UHFFFAOYSA-N
MW300.38 g/mol
LogP3.15
Rot. Bonds5

About 2-[(2-ethylsulfanylbenzoyl)amino]benzamide

2-[(2-ethylsulfanylbenzoyl)amino]benzamide (PubChem CID 4631713) has the molecular formula C16H16N2O2S and a molecular weight of 300.38 g/mol. Its IUPAC name is 2-[(2-ethylsulfanylbenzoyl)amino]benzamide.

Molecular Properties

Compound Name2-[(2-ethylsulfanylbenzoyl)amino]benzamide
PubChem CID4631713
Molecular FormulaC16H16N2O2S
Molecular Weight300.38 g/mol
Exact Mass300.09
IUPAC Name2-[(2-ethylsulfanylbenzoyl)amino]benzamide
SMILESCCSc1ccccc1C(=O)Nc1ccccc1C(N)=O
InChIInChI=1S/C16H16N2O2S/c1-2-21-14-10-6-4-8-12(14)16(20)18-13-9-5-3-7-11(13)15(17)19/h3-10H,2H2,1H3,(H2,17,19)(H,18,20)
InChIKeyXOPJBQUPCRNZKU-UHFFFAOYSA-N
XLogP3.15
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-ethylsulfanylbenzoyl)amino]benzoic acid
CID 17204466
N-(2-ethylsulfanylphenyl)-2-methylsulfanylbenzamide
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N-(2-ethylsulfanylphenyl)-2-iodobenzamide
CID 47310864
2-[[2-(ethylamino)benzoyl]amino]benzamide
CID 63107722
2-(ethylamino)-N-(2-ethylsulfanylphenyl)benzamide
CID 63107839
2-amino-N-(2-ethylsulfanylphenyl)-3-methylbenzamide
CID 61104682
2-ethylsulfanyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzamide
CID 8795745
2-ethylsulfanyl-N-[2-[2-(3-methylphenyl)acetyl]phenyl]benzamide
CID 158896086
2-[(2-propylsulfonylbenzoyl)amino]benzamide
CID 17224890
2-amino-3-chloro-N-(2-ethylsulfanylphenyl)benzamide
CID 115540166
N-(4-bromo-2-methylphenyl)-2-ethylsulfanylbenzamide
CID 4631177
2-ethylsulfanyl-N-(5-hydroxy-2-methyl-4-pyridinyl)benzamide
CID 126683060

Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethylsulfanylbenzoyl)amino]benzamide?
The IUPAC name of 2-[(2-ethylsulfanylbenzoyl)amino]benzamide (CID 4631713) is 2-[(2-ethylsulfanylbenzoyl)amino]benzamide.
What is the SMILES notation for 2-[(2-ethylsulfanylbenzoyl)amino]benzamide?
The canonical SMILES for 2-[(2-ethylsulfanylbenzoyl)amino]benzamide is CCSc1ccccc1C(=O)Nc1ccccc1C(N)=O.
What is the InChIKey of 2-[(2-ethylsulfanylbenzoyl)amino]benzamide?
The InChIKey is XOPJBQUPCRNZKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2S/c1-2-21-14-10-6-4-8-12(14)16(20)18-13-9-5-3-7-11(13)15(17)19/h3-10H,2H2,1H3,(H2,17,19)(H,18,20).
What are the key properties of 2-[(2-ethylsulfanylbenzoyl)amino]benzamide?
2-[(2-ethylsulfanylbenzoyl)amino]benzamide has a molecular weight of 300.38 g/mol, XLogP of 3.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethylsulfanylbenzoyl)amino]benzamide is sourced from PubChem (CID 4631713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).