N-(4-methylphenyl)thiophene-2-carboxamide

C12H11NOS — CID 2292972

IUPACN-(4-methylphenyl)thiophene-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccs2)cc1
InChIInChI=1S/C12H11NOS/c1-9-4-6-10(7-5-9)13-12(14)11-3-2-8-15-11/h2-8H,1H3,(H,13,14)
InChIKeyWRENGQYLTDHYJS-UHFFFAOYSA-N
MW217.29 g/mol
LogP3.31
Rot. Bonds2

About N-(4-methylphenyl)thiophene-2-carboxamide

N-(4-methylphenyl)thiophene-2-carboxamide (PubChem CID 2292972) has the molecular formula C12H11NOS and a molecular weight of 217.29 g/mol. Its IUPAC name is N-(4-methylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(4-methylphenyl)thiophene-2-carboxamide
PubChem CID2292972
Molecular FormulaC12H11NOS
Molecular Weight217.29 g/mol
Exact Mass217.06
IUPAC NameN-(4-methylphenyl)thiophene-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccs2)cc1
InChIInChI=1S/C12H11NOS/c1-9-4-6-10(7-5-9)13-12(14)11-3-2-8-15-11/h2-8H,1H3,(H,13,14)
InChIKeyWRENGQYLTDHYJS-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-(4-methylphenyl)thiophene-2-carboxamide?
The IUPAC name of N-(4-methylphenyl)thiophene-2-carboxamide (CID 2292972) is N-(4-methylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(4-methylphenyl)thiophene-2-carboxamide?
The canonical SMILES for N-(4-methylphenyl)thiophene-2-carboxamide is Cc1ccc(NC(=O)c2cccs2)cc1.
What is the InChIKey of N-(4-methylphenyl)thiophene-2-carboxamide?
The InChIKey is WRENGQYLTDHYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NOS/c1-9-4-6-10(7-5-9)13-12(14)11-3-2-8-15-11/h2-8H,1H3,(H,13,14).
What are the key properties of N-(4-methylphenyl)thiophene-2-carboxamide?
N-(4-methylphenyl)thiophene-2-carboxamide 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-(4-methylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 2292972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).