5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide

C10H6BrIN2OS — CID 65098648

IUPAC5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide
SMILESO=C(Nc1ccc(I)cn1)c1ccc(Br)s1
InChIInChI=1S/C10H6BrIN2OS/c11-8-3-2-7(16-8)10(15)14-9-4-1-6(12)5-13-9/h1-5H,(H,13,14,15)
InChIKeyYQPXNODSLOPPED-UHFFFAOYSA-N
MW409.05 g/mol
LogP3.76
Rot. Bonds2

About 5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide

5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide (PubChem CID 65098648) has the molecular formula C10H6BrIN2OS and a molecular weight of 409.05 g/mol. Its IUPAC name is 5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide
PubChem CID65098648
Molecular FormulaC10H6BrIN2OS
Molecular Weight409.05 g/mol
Exact Mass407.84
IUPAC Name5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide
SMILESO=C(Nc1ccc(I)cn1)c1ccc(Br)s1
InChIInChI=1S/C10H6BrIN2OS/c11-8-3-2-7(16-8)10(15)14-9-4-1-6(12)5-13-9/h1-5H,(H,13,14,15)
InChIKeyYQPXNODSLOPPED-UHFFFAOYSA-N
XLogP3.76
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.05
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

5-bromo-N-(5-cyano-2-pyridinyl)thiophene-2-carboxamide
CID 62353535
2-[(5-bromothiophene-2-carbonyl)amino]-5-iodobenzoic acid
CID 45345767
5-bromo-N-[2-[(5-methyl-2-pyridinyl)amino]-2-oxoethyl]thiophene-2-carboxamide
CID 47265799
5-bromo-2-iodo-N-(5-iodo-2-pyridinyl)benzamide
CID 114033128
2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide
CID 23440185
5-bromo-N-(4-methyl-2-pyridinyl)thiophene-2-carboxamide chloride
CID 53352579
5-bromo-N-(2-bromo-3-pyridinyl)thiophene-2-carboxamide
CID 103819443
5-bromo-N-(3,5-dibromopyrazin-2-yl)thiophene-2-carboxamide
CID 103756307
N-(5-bromo-2-pyridinyl)-4-iodobenzamide
CID 4066488
3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide
CID 65098988
5-bromo-N-(2-methyl-3-pyridinyl)thiophene-2-carboxamide
CID 79043907
5-bromo-N-(2-phenylpyrimidin-5-yl)thiophene-2-carboxamide
CID 46439802

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide?
The IUPAC name of 5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide (CID 65098648) is 5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide?
The canonical SMILES for 5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide is O=C(Nc1ccc(I)cn1)c1ccc(Br)s1.
What is the InChIKey of 5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide?
The InChIKey is YQPXNODSLOPPED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrIN2OS/c11-8-3-2-7(16-8)10(15)14-9-4-1-6(12)5-13-9/h1-5H,(H,13,14,15).
What are the key properties of 5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide?
5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide has a molecular weight of 409.05 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(5-iodo-2-pyridinyl)thiophene-2-carboxamide is sourced from PubChem (CID 65098648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).