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

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Related Compounds

4-((4-(1-Cyclopropyl-2-methyl-1H-imidazol-5-YL)pyrimidin-2-YL)amino)-N-methylbenzenesulfonamide
CID 24901723
1-Ethyl-4-(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)piperazine
CID 4877436
2-fluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzenesulfonamide
CID 16195005
4-(2-Pyridin-3-yl-4-trifluoromethyl-imidazol-1-yl)-benzenesulfonamide
CID 9799387
4-[2-(5-Methyl-pyridin-3-yl)-4-trifluoromethyl-imidazol-1-yl]-benzenesulfonamide
CID 9842937
4-(1-Ethyl-2-methylimidazol-5-yl)-2-{4-[n-(2-methoxyethyl)sulphamoyl]anilino}pyrimidine
CID 10158868
4-[2-(6-Methyl-pyridin-2-yl)-4-trifluoromethyl-imidazol-1-yl]-benzenesulfonamide
CID 10271231
4-[2-(6-Methyl-pyridin-3-yl)-4-trifluoromethyl-imidazol-1-yl]-benzenesulfonamide
CID 10293242
N-(2-methoxyethyl)-4-(4-(1,2,4-trimethyl-1H-imidazol-5-yl)pyrimidin-2-ylamino)benzenesulfonamide
CID 17933136
4-(4-(1,2-dimethyl-1H-imidazol-5-yl)pyrimidin-2-ylamino)-N-(2-methoxyethyl)benzenesulfonamide
CID 22273524
4-(1,2-Dimethylimidazol-5-yl)-2-[4-(N-methylsulphamoyl)anilino]pyrimidine
CID 22273530
4-(4-(1,2-dimethyl-1H-imidazol-5-yl)pyrimidin-2-ylamino)benzenesulfonamide
CID 22273548

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).