2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide

C17H11F2N3O3S — CID 167885546

IUPAC2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide
SMILESNC(=O)c1ccc(C(=O)Nc2ccc(Oc3cc(F)cc(F)c3)nc2)s1
InChIInChI=1S/C17H11F2N3O3S/c18-9-5-10(19)7-12(6-9)25-15-4-1-11(8-21-15)22-17(24)14-3-2-13(26-14)16(20)23/h1-8H,(H2,20,23)(H,22,24)
InChIKeyFUFDXNBANNXDTR-UHFFFAOYSA-N
MW375.36 g/mol
LogP3.56
Rot. Bonds5

About 2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide

2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide (PubChem CID 167885546) has the molecular formula C17H11F2N3O3S and a molecular weight of 375.36 g/mol. Its IUPAC name is 2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide
PubChem CID167885546
Molecular FormulaC17H11F2N3O3S
Molecular Weight375.36 g/mol
Exact Mass375.05
IUPAC Name2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide
SMILESNC(=O)c1ccc(C(=O)Nc2ccc(Oc3cc(F)cc(F)c3)nc2)s1
InChIInChI=1S/C17H11F2N3O3S/c18-9-5-10(19)7-12(6-9)25-15-4-1-11(8-21-15)22-17(24)14-3-2-13(26-14)16(20)23/h1-8H,(H2,20,23)(H,22,24)
InChIKeyFUFDXNBANNXDTR-UHFFFAOYSA-N
XLogP3.56
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.36
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide?
The IUPAC name of 2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide (CID 167885546) is 2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide.
What is the SMILES notation for 2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide?
The canonical SMILES for 2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide is NC(=O)c1ccc(C(=O)Nc2ccc(Oc3cc(F)cc(F)c3)nc2)s1.
What is the InChIKey of 2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide?
The InChIKey is FUFDXNBANNXDTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F2N3O3S/c18-9-5-10(19)7-12(6-9)25-15-4-1-11(8-21-15)22-17(24)14-3-2-13(26-14)16(20)23/h1-8H,(H2,20,23)(H,22,24).
What are the key properties of 2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide?
2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide has a molecular weight of 375.36 g/mol, XLogP of 3.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[6-(3,5-difluorophenoxy)-3-pyridinyl]thiophene-2,5-dicarboxamide is sourced from PubChem (CID 167885546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).