5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide

C10H14ClN5O2S — CID 47235688

IUPAC5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide
SMILESCn1cc(CCNS(=O)(=O)c2ncn(C)c2Cl)cn1
InChIInChI=1S/C10H14ClN5O2S/c1-15-7-12-10(9(15)11)19(17,18)14-4-3-8-5-13-16(2)6-8/h5-7,14H,3-4H2,1-2H3
InChIKeyLXPRAMYLOUBOOZ-UHFFFAOYSA-N
MW303.78 g/mol
LogP0.33
Rot. Bonds5

About 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide

5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide (PubChem CID 47235688) has the molecular formula C10H14ClN5O2S and a molecular weight of 303.78 g/mol. Its IUPAC name is 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide.

Molecular Properties

Compound Name5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide
PubChem CID47235688
Molecular FormulaC10H14ClN5O2S
Molecular Weight303.78 g/mol
Exact Mass303.06
IUPAC Name5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide
SMILESCn1cc(CCNS(=O)(=O)c2ncn(C)c2Cl)cn1
InChIInChI=1S/C10H14ClN5O2S/c1-15-7-12-10(9(15)11)19(17,18)14-4-3-8-5-13-16(2)6-8/h5-7,14H,3-4H2,1-2H3
InChIKeyLXPRAMYLOUBOOZ-UHFFFAOYSA-N
XLogP0.33
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.78
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-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 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide?
The IUPAC name of 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide (CID 47235688) is 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide.
What is the SMILES notation for 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide?
The canonical SMILES for 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide is Cn1cc(CCNS(=O)(=O)c2ncn(C)c2Cl)cn1.
What is the InChIKey of 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide?
The InChIKey is LXPRAMYLOUBOOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN5O2S/c1-15-7-12-10(9(15)11)19(17,18)14-4-3-8-5-13-16(2)6-8/h5-7,14H,3-4H2,1-2H3.
What are the key properties of 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide?
5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide has a molecular weight of 303.78 g/mol, XLogP of 0.33, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-1-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]imidazole-4-sulfonamide is sourced from PubChem (CID 47235688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).