N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide

C10H12N4O2S — CID 64592738

IUPACN-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(-n2ccnc2)nc1
InChIInChI=1S/C10H12N4O2S/c1-2-17(15,16)13-9-3-4-10(12-7-9)14-6-5-11-8-14/h3-8,13H,2H2,1H3
InChIKeyCREZGSJQIMFGHF-UHFFFAOYSA-N
MW252.30 g/mol
LogP1.03
Rot. Bonds4

About N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide

N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide (PubChem CID 64592738) has the molecular formula C10H12N4O2S and a molecular weight of 252.30 g/mol. Its IUPAC name is N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide
PubChem CID64592738
Molecular FormulaC10H12N4O2S
Molecular Weight252.30 g/mol
Exact Mass252.07
IUPAC NameN-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(-n2ccnc2)nc1
InChIInChI=1S/C10H12N4O2S/c1-2-17(15,16)13-9-3-4-10(12-7-9)14-6-5-11-8-14/h3-8,13H,2H2,1H3
InChIKeyCREZGSJQIMFGHF-UHFFFAOYSA-N
XLogP1.03
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.30
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(6-imidazol-1-yl-3-pyridinyl)butane-1-sulfonamide
CID 90608258
6-imidazol-1-yl-N-propylpyridin-3-amine
CID 43710767
N-tert-butyl-6-imidazol-1-ylpyridin-3-amine
CID 167253831
N-(6-imidazol-1-yl-3-pyridinyl)-2,5-dimethylbenzenesulfonamide
CID 56777957
N-(6-imidazol-1-yl-3-pyridinyl)butanamide
CID 35437719
N-(6-imidazol-1-yl-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 71801231
N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]ethanesulfonamide
CID 113011044
N-heptan-3-yl-6-imidazol-1-ylpyridin-3-amine
CID 63945117
2-bromo-N-(6-imidazol-1-yl-3-pyridinyl)butanamide
CID 62855029
ethyl 2-[(6-imidazol-1-yl-3-pyridinyl)amino]-2-oxoacetate
CID 90564814
N-(6-imidazol-1-yl-3-pyridinyl)-2-methylpropanamide
CID 35437698
N-(6-morpholin-4-yl-3-pyridinyl)ethanesulfonamide
CID 53016560

Frequently Asked Questions

What is the IUPAC name of N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide?
The IUPAC name of N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide (CID 64592738) is N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide.
What is the SMILES notation for N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide?
The canonical SMILES for N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide is CCS(=O)(=O)Nc1ccc(-n2ccnc2)nc1.
What is the InChIKey of N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide?
The InChIKey is CREZGSJQIMFGHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2S/c1-2-17(15,16)13-9-3-4-10(12-7-9)14-6-5-11-8-14/h3-8,13H,2H2,1H3.
What are the key properties of N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide?
N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide has a molecular weight of 252.30 g/mol, XLogP of 1.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-imidazol-1-yl-3-pyridinyl)ethanesulfonamide is sourced from PubChem (CID 64592738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).