4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide

C10H7F2NOS2 — CID 45087039

IUPAC4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide
SMILESO=C(Nc1ccsc1)c1cscc1C(F)F
InChIInChI=1S/C10H7F2NOS2/c11-9(12)7-4-16-5-8(7)10(14)13-6-1-2-15-3-6/h1-5,9H,(H,13,14)
InChIKeyNZQBTEXAFFACFE-UHFFFAOYSA-N
MW259.30 g/mol
LogP4.00
Rot. Bonds3

About 4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide

4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide (PubChem CID 45087039) has the molecular formula C10H7F2NOS2 and a molecular weight of 259.30 g/mol. Its IUPAC name is 4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide.

Molecular Properties

Compound Name4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide
PubChem CID45087039
Molecular FormulaC10H7F2NOS2
Molecular Weight259.30 g/mol
Exact Mass258.99
IUPAC Name4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide
SMILESO=C(Nc1ccsc1)c1cscc1C(F)F
InChIInChI=1S/C10H7F2NOS2/c11-9(12)7-4-16-5-8(7)10(14)13-6-1-2-15-3-6/h1-5,9H,(H,13,14)
InChIKeyNZQBTEXAFFACFE-UHFFFAOYSA-N
XLogP4.00
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide?
The IUPAC name of 4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide (CID 45087039) is 4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide.
What is the SMILES notation for 4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide?
The canonical SMILES for 4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide is O=C(Nc1ccsc1)c1cscc1C(F)F.
What is the InChIKey of 4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide?
The InChIKey is NZQBTEXAFFACFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2NOS2/c11-9(12)7-4-16-5-8(7)10(14)13-6-1-2-15-3-6/h1-5,9H,(H,13,14).
What are the key properties of 4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide?
4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide has a molecular weight of 259.30 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-N-thiophen-3-ylthiophene-3-carboxamide is sourced from PubChem (CID 45087039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).