4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide

C15H16N2OS — CID 107643040

IUPAC4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide
SMILESCNc1ccc(C(=O)Nc2ccccc2SC)cc1
InChIInChI=1S/C15H16N2OS/c1-16-12-9-7-11(8-10-12)15(18)17-13-5-3-4-6-14(13)19-2/h3-10,16H,1-2H3,(H,17,18)
InChIKeyQENDBSXUUMZQKE-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.70
Rot. Bonds4

About 4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide

4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide (PubChem CID 107643040) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is 4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide.

Molecular Properties

Compound Name4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide
PubChem CID107643040
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC Name4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide
SMILESCNc1ccc(C(=O)Nc2ccccc2SC)cc1
InChIInChI=1S/C15H16N2OS/c1-16-12-9-7-11(8-10-12)15(18)17-13-5-3-4-6-14(13)19-2/h3-10,16H,1-2H3,(H,17,18)
InChIKeyQENDBSXUUMZQKE-UHFFFAOYSA-N
XLogP3.70
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-iodo-N-(2-methylsulfanylphenyl)benzamide
CID 2238716
4-chloro-N-(2-methylsulfanylphenyl)benzamide
CID 2091832
4-(methylamino)-N-(2-propan-2-ylphenyl)benzamide
CID 62185459
N-(2-methylsulfanylphenyl)pyridine-4-carboxamide
CID 1244343
4-[(4-acetylphenyl)sulfonylamino]-N-(2-methylsulfanylphenyl)benzamide
CID 25348450
4-[(4-chlorophenyl)sulfonylamino]-N-(2-methylsulfanylphenyl)benzamide
CID 41318735
3-hydroxy-4-methyl-N-(2-methylsulfanylphenyl)benzamide
CID 103955489
3-bromo-4-methyl-N-(2-methylsulfanylphenyl)benzamide
CID 81472688
3-chloro-4-iodo-N-(2-methylsulfanylphenyl)benzamide
CID 103221338
N-methyl-4-[[2-[methyl-[2-(2-methylsulfanylanilino)-2-oxoethyl]amino]acetyl]amino]benzamide
CID 8814792
3-amino-N-(2-methylsulfanylphenyl)benzamide
CID 43702687
4-(methylamino)-N-(2-methyl-3-pyridinyl)benzamide
CID 79043682

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide?
The IUPAC name of 4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide (CID 107643040) is 4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide.
What is the SMILES notation for 4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide?
The canonical SMILES for 4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide is CNc1ccc(C(=O)Nc2ccccc2SC)cc1.
What is the InChIKey of 4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide?
The InChIKey is QENDBSXUUMZQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c1-16-12-9-7-11(8-10-12)15(18)17-13-5-3-4-6-14(13)19-2/h3-10,16H,1-2H3,(H,17,18).
What are the key properties of 4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide?
4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide has a molecular weight of 272.37 g/mol, XLogP of 3.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-(2-methylsulfanylphenyl)benzamide is sourced from PubChem (CID 107643040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).