4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide

C11H13N3O2S2 — CID 107886913

IUPAC4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide
SMILESNCc1csc(S(=O)(=O)NCc2ccccn2)c1
InChIInChI=1S/C11H13N3O2S2/c12-6-9-5-11(17-8-9)18(15,16)14-7-10-3-1-2-4-13-10/h1-5,8,14H,6-7,12H2
InChIKeyFFDZZZUXJRIUEU-UHFFFAOYSA-N
MW283.38 g/mol
LogP1.08
Rot. Bonds5

About 4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide

4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide (PubChem CID 107886913) has the molecular formula C11H13N3O2S2 and a molecular weight of 283.38 g/mol. Its IUPAC name is 4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide
PubChem CID107886913
Molecular FormulaC11H13N3O2S2
Molecular Weight283.38 g/mol
Exact Mass283.04
IUPAC Name4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide
SMILESNCc1csc(S(=O)(=O)NCc2ccccn2)c1
InChIInChI=1S/C11H13N3O2S2/c12-6-9-5-11(17-8-9)18(15,16)14-7-10-3-1-2-4-13-10/h1-5,8,14H,6-7,12H2
InChIKeyFFDZZZUXJRIUEU-UHFFFAOYSA-N
XLogP1.08
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(aminomethyl)-N-[(6-methyl-3-pyridinyl)methyl]thiophene-2-sulfonamide
CID 106062675
4-(aminomethyl)-N-[(3,4-difluorophenyl)methyl]thiophene-2-sulfonamide
CID 106052083
4-(5-ethyl-1,3,4-oxadiazol-2-yl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide
CID 53199696
4-(aminomethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]thiophene-2-sulfonamide
CID 106378096
5-(aminomethyl)-2-methoxy-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 28717822
4-(aminomethyl)-N-quinolin-8-ylthiophene-2-sulfonamide
CID 106048429
3-(aminomethyl)-2,5-dichloro-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 107680363
4-amino-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 3663787
3-amino-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 16795667
4-(aminomethyl)-N-pyridazin-3-ylthiophene-2-sulfonamide
CID 106084249
4-(aminomethyl)-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thiophene-2-sulfonamide
CID 106378242
4-(aminomethyl)-N-(2-chlorophenyl)thiophene-2-sulfonamide
CID 114141245

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide?
The IUPAC name of 4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide (CID 107886913) is 4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide?
The canonical SMILES for 4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide is NCc1csc(S(=O)(=O)NCc2ccccn2)c1.
What is the InChIKey of 4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide?
The InChIKey is FFDZZZUXJRIUEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2S2/c12-6-9-5-11(17-8-9)18(15,16)14-7-10-3-1-2-4-13-10/h1-5,8,14H,6-7,12H2.
What are the key properties of 4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide?
4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide has a molecular weight of 283.38 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-(pyridin-2-ylmethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 107886913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).