3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide

C11H12N2O3S2 — CID 166219703

IUPAC3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide
SMILESCOc1ccsc1S(=O)(=O)Nc1ccncc1C
InChIInChI=1S/C11H12N2O3S2/c1-8-7-12-5-3-9(8)13-18(14,15)11-10(16-2)4-6-17-11/h3-7H,1-2H3,(H,12,13)
InChIKeyJDCMUTLVDRXVHR-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.26
Rot. Bonds4

About 3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide

3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide (PubChem CID 166219703) has the molecular formula C11H12N2O3S2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide
PubChem CID166219703
Molecular FormulaC11H12N2O3S2
Molecular Weight284.36 g/mol
Exact Mass284.03
IUPAC Name3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide
SMILESCOc1ccsc1S(=O)(=O)Nc1ccncc1C
InChIInChI=1S/C11H12N2O3S2/c1-8-7-12-5-3-9(8)13-18(14,15)11-10(16-2)4-6-17-11/h3-7H,1-2H3,(H,12,13)
InChIKeyJDCMUTLVDRXVHR-UHFFFAOYSA-N
XLogP2.26
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide?
The IUPAC name of 3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide (CID 166219703) is 3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide.
What is the SMILES notation for 3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide?
The canonical SMILES for 3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide is COc1ccsc1S(=O)(=O)Nc1ccncc1C.
What is the InChIKey of 3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide?
The InChIKey is JDCMUTLVDRXVHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O3S2/c1-8-7-12-5-3-9(8)13-18(14,15)11-10(16-2)4-6-17-11/h3-7H,1-2H3,(H,12,13).
What are the key properties of 3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide?
3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide has a molecular weight of 284.36 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(3-methyl-4-pyridinyl)thiophene-2-sulfonamide is sourced from PubChem (CID 166219703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).