2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide

C16H14N2O4S — CID 2314061

IUPAC2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide
SMILESO=C(NCc1ccco1)c1ccc(C(=O)NCc2ccco2)s1
InChIInChI=1S/C16H14N2O4S/c19-15(17-9-11-3-1-7-21-11)13-5-6-14(23-13)16(20)18-10-12-4-2-8-22-12/h1-8H,9-10H2,(H,17,19)(H,18,20)
InChIKeyBAUSLVZPMPHTHQ-UHFFFAOYSA-N
MW330.36 g/mol
LogP2.79
Rot. Bonds6

About 2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide

2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide (PubChem CID 2314061) has the molecular formula C16H14N2O4S and a molecular weight of 330.36 g/mol. Its IUPAC name is 2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide
PubChem CID2314061
Molecular FormulaC16H14N2O4S
Molecular Weight330.36 g/mol
Exact Mass330.07
IUPAC Name2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide
SMILESO=C(NCc1ccco1)c1ccc(C(=O)NCc2ccco2)s1
InChIInChI=1S/C16H14N2O4S/c19-15(17-9-11-3-1-7-21-11)13-5-6-14(23-13)16(20)18-10-12-4-2-8-22-12/h1-8H,9-10H2,(H,17,19)(H,18,20)
InChIKeyBAUSLVZPMPHTHQ-UHFFFAOYSA-N
XLogP2.79
TPSA84.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide?
The IUPAC name of 2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide (CID 2314061) is 2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide.
What is the SMILES notation for 2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide?
The canonical SMILES for 2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide is O=C(NCc1ccco1)c1ccc(C(=O)NCc2ccco2)s1.
What is the InChIKey of 2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide?
The InChIKey is BAUSLVZPMPHTHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O4S/c19-15(17-9-11-3-1-7-21-11)13-5-6-14(23-13)16(20)18-10-12-4-2-8-22-12/h1-8H,9-10H2,(H,17,19)(H,18,20).
What are the key properties of 2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide?
2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide has a molecular weight of 330.36 g/mol, XLogP of 2.79, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,5-N-bis(furan-2-ylmethyl)thiophene-2,5-dicarboxamide is sourced from PubChem (CID 2314061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).