4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide

C20H14N2OS — CID 25218751

IUPAC4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide
SMILESNC(=O)c1cc2c(-c3cccc(-c4ccccc4)c3)cncc2s1
InChIInChI=1S/C20H14N2OS/c21-20(23)18-10-16-17(11-22-12-19(16)24-18)15-8-4-7-14(9-15)13-5-2-1-3-6-13/h1-12H,(H2,21,23)
InChIKeyNUNDFMJANFGRPS-UHFFFAOYSA-N
MW330.41 g/mol
LogP4.73
Rot. Bonds3

About 4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide

4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide (PubChem CID 25218751) has the molecular formula C20H14N2OS and a molecular weight of 330.41 g/mol. Its IUPAC name is 4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide
PubChem CID25218751
Molecular FormulaC20H14N2OS
Molecular Weight330.41 g/mol
Exact Mass330.08
IUPAC Name4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide
SMILESNC(=O)c1cc2c(-c3cccc(-c4ccccc4)c3)cncc2s1
InChIInChI=1S/C20H14N2OS/c21-20(23)18-10-16-17(11-22-12-19(16)24-18)15-8-4-7-14(9-15)13-5-2-1-3-6-13/h1-12H,(H2,21,23)
InChIKeyNUNDFMJANFGRPS-UHFFFAOYSA-N
XLogP4.73
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide?
The IUPAC name of 4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide (CID 25218751) is 4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for 4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for 4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide is NC(=O)c1cc2c(-c3cccc(-c4ccccc4)c3)cncc2s1.
What is the InChIKey of 4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide?
The InChIKey is NUNDFMJANFGRPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2OS/c21-20(23)18-10-16-17(11-22-12-19(16)24-18)15-8-4-7-14(9-15)13-5-2-1-3-6-13/h1-12H,(H2,21,23).
What are the key properties of 4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide?
4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide has a molecular weight of 330.41 g/mol, XLogP of 4.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 25218751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).