N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide

C11H14N4O2S — CID 47084788

IUPACN-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide
SMILESCn1ccnc1CCNS(=O)(=O)c1cccnc1
InChIInChI=1S/C11H14N4O2S/c1-15-8-7-13-11(15)4-6-14-18(16,17)10-3-2-5-12-9-10/h2-3,5,7-9,14H,4,6H2,1H3
InChIKeyUIQPCKLFHKSDAP-UHFFFAOYSA-N
MW266.33 g/mol
LogP0.34
Rot. Bonds5

About N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide

N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide (PubChem CID 47084788) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide
PubChem CID47084788
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC NameN-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide
SMILESCn1ccnc1CCNS(=O)(=O)c1cccnc1
InChIInChI=1S/C11H14N4O2S/c1-15-8-7-13-11(15)4-6-14-18(16,17)10-3-2-5-12-9-10/h2-3,5,7-9,14H,4,6H2,1H3
InChIKeyUIQPCKLFHKSDAP-UHFFFAOYSA-N
XLogP0.34
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide?
The IUPAC name of N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide (CID 47084788) is N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide?
The canonical SMILES for N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide is Cn1ccnc1CCNS(=O)(=O)c1cccnc1.
What is the InChIKey of N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide?
The InChIKey is UIQPCKLFHKSDAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-15-8-7-13-11(15)4-6-14-18(16,17)10-3-2-5-12-9-10/h2-3,5,7-9,14H,4,6H2,1H3.
What are the key properties of N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide?
N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide has a molecular weight of 266.33 g/mol, XLogP of 0.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide is sourced from PubChem (CID 47084788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).