N-(5-methylthiophen-3-yl)benzamide

C12H11NOS — CID 142100970

IUPACN-(5-methylthiophen-3-yl)benzamide
SMILESCc1cc(NC(=O)c2ccccc2)cs1
InChIInChI=1S/C12H11NOS/c1-9-7-11(8-15-9)13-12(14)10-5-3-2-4-6-10/h2-8H,1H3,(H,13,14)
InChIKeyQEBCLDSCDCJQCL-UHFFFAOYSA-N
MW217.29 g/mol
LogP3.31
Rot. Bonds2

About N-(5-methylthiophen-3-yl)benzamide

N-(5-methylthiophen-3-yl)benzamide (PubChem CID 142100970) has the molecular formula C12H11NOS and a molecular weight of 217.29 g/mol. Its IUPAC name is N-(5-methylthiophen-3-yl)benzamide.

Molecular Properties

Compound NameN-(5-methylthiophen-3-yl)benzamide
PubChem CID142100970
Molecular FormulaC12H11NOS
Molecular Weight217.29 g/mol
Exact Mass217.06
IUPAC NameN-(5-methylthiophen-3-yl)benzamide
SMILESCc1cc(NC(=O)c2ccccc2)cs1
InChIInChI=1S/C12H11NOS/c1-9-7-11(8-15-9)13-12(14)10-5-3-2-4-6-10/h2-8H,1H3,(H,13,14)
InChIKeyQEBCLDSCDCJQCL-UHFFFAOYSA-N
XLogP3.31
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.29
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-methylthiophen-3-yl)benzamide?
The IUPAC name of N-(5-methylthiophen-3-yl)benzamide (CID 142100970) is N-(5-methylthiophen-3-yl)benzamide.
What is the SMILES notation for N-(5-methylthiophen-3-yl)benzamide?
The canonical SMILES for N-(5-methylthiophen-3-yl)benzamide is Cc1cc(NC(=O)c2ccccc2)cs1.
What is the InChIKey of N-(5-methylthiophen-3-yl)benzamide?
The InChIKey is QEBCLDSCDCJQCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NOS/c1-9-7-11(8-15-9)13-12(14)10-5-3-2-4-6-10/h2-8H,1H3,(H,13,14).
What are the key properties of N-(5-methylthiophen-3-yl)benzamide?
N-(5-methylthiophen-3-yl)benzamide has a molecular weight of 217.29 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylthiophen-3-yl)benzamide is sourced from PubChem (CID 142100970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).