N-methyl-N-phenylthiophene-2-carboxamide

C12H11NOS — CID 767645

IUPACN-methyl-N-phenylthiophene-2-carboxamide
SMILESCN(C(=O)c1cccs1)c1ccccc1
InChIInChI=1S/C12H11NOS/c1-13(10-6-3-2-4-7-10)12(14)11-8-5-9-15-11/h2-9H,1H3
InChIKeyBOZHRPMAQWSIKH-UHFFFAOYSA-N
MW217.29 g/mol
LogP3.02
Rot. Bonds2

About N-methyl-N-phenylthiophene-2-carboxamide

N-methyl-N-phenylthiophene-2-carboxamide (PubChem CID 767645) has the molecular formula C12H11NOS and a molecular weight of 217.29 g/mol. Its IUPAC name is N-methyl-N-phenylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-phenylthiophene-2-carboxamide
PubChem CID767645
Molecular FormulaC12H11NOS
Molecular Weight217.29 g/mol
Exact Mass217.06
IUPAC NameN-methyl-N-phenylthiophene-2-carboxamide
SMILESCN(C(=O)c1cccs1)c1ccccc1
InChIInChI=1S/C12H11NOS/c1-13(10-6-3-2-4-7-10)12(14)11-8-5-9-15-11/h2-9H,1H3
InChIKeyBOZHRPMAQWSIKH-UHFFFAOYSA-N
XLogP3.02
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.29
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenylthiophene-2-carboxamide?
The IUPAC name of N-methyl-N-phenylthiophene-2-carboxamide (CID 767645) is N-methyl-N-phenylthiophene-2-carboxamide.
What is the SMILES notation for N-methyl-N-phenylthiophene-2-carboxamide?
The canonical SMILES for N-methyl-N-phenylthiophene-2-carboxamide is CN(C(=O)c1cccs1)c1ccccc1.
What is the InChIKey of N-methyl-N-phenylthiophene-2-carboxamide?
The InChIKey is BOZHRPMAQWSIKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NOS/c1-13(10-6-3-2-4-7-10)12(14)11-8-5-9-15-11/h2-9H,1H3.
What are the key properties of N-methyl-N-phenylthiophene-2-carboxamide?
N-methyl-N-phenylthiophene-2-carboxamide has a molecular weight of 217.29 g/mol, XLogP of 3.02, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenylthiophene-2-carboxamide is sourced from PubChem (CID 767645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).