1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride

C8H15ClN4O2S — CID 66934082

IUPAC1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride
SMILESCl.Cn1cnc(S(=O)(=O)N2CCNCC2)c1
InChIInChI=1S/C8H14N4O2S.ClH/c1-11-6-8(10-7-11)15(13,14)12-4-2-9-3-5-12;/h6-7,9H,2-5H2,1H3;1H
InChIKeyVAEMIXMTAIERRP-UHFFFAOYSA-N
MW266.75 g/mol
LogP-0.56
Rot. Bonds2

About 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride

1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride (PubChem CID 66934082) has the molecular formula C8H15ClN4O2S and a molecular weight of 266.75 g/mol. Its IUPAC name is 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride.

Molecular Properties

Compound Name1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride
PubChem CID66934082
Molecular FormulaC8H15ClN4O2S
Molecular Weight266.75 g/mol
Exact Mass266.06
IUPAC Name1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride
SMILESCl.Cn1cnc(S(=O)(=O)N2CCNCC2)c1
InChIInChI=1S/C8H14N4O2S.ClH/c1-11-6-8(10-7-11)15(13,14)12-4-2-9-3-5-12;/h6-7,9H,2-5H2,1H3;1H
InChIKeyVAEMIXMTAIERRP-UHFFFAOYSA-N
XLogP-0.56
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.75
LogP ≤ 5-0.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride with MolForge

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

Launch Full Analysis

Related Compounds

1-(1-methylimidazol-4-yl)sulfonylpiperazine
CID 20735186
2-(1-methylimidazol-4-yl)sulfonyl-2,8-diazaspiro[4.5]decane
CID 120718639
(2S)-2-methyl-1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride
CID 120717155
4-bromo-1-(1-methylimidazol-4-yl)sulfonylpiperidine
CID 80673248
(4S)-1-(1-methylimidazol-4-yl)sulfonylazepan-4-amine
CID 95715901
2-(1-methylimidazol-4-yl)sulfonyl-1,3,3a,4,5,6,7,7a-octahydroisoindole
CID 71861370
1-(1-methylimidazol-4-yl)sulfonylpyrrolidin-3-ol
CID 62916956
N-methyl-1-(1-methylimidazol-4-yl)sulfonylpiperidin-3-amine;hydrochloride
CID 120714982
N,1-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)imidazole-4-sulfonamide
CID 62373281
3-methyl-1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-amine;hydrochloride
CID 119984050
4-methyl-1-(1-methylimidazol-4-yl)sulfonylpiperidine-4-carbothioamide
CID 107161341
4-[4-(1-methylimidazol-4-yl)sulfonylpiperazin-1-yl]-6-(4-methylpiperazin-1-yl)pyrimidine
CID 122343615

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride?
The IUPAC name of 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride (CID 66934082) is 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride.
What is the SMILES notation for 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride?
The canonical SMILES for 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride is Cl.Cn1cnc(S(=O)(=O)N2CCNCC2)c1.
What is the InChIKey of 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride?
The InChIKey is VAEMIXMTAIERRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2S.ClH/c1-11-6-8(10-7-11)15(13,14)12-4-2-9-3-5-12;/h6-7,9H,2-5H2,1H3;1H.
What are the key properties of 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride?
1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride has a molecular weight of 266.75 g/mol, XLogP of -0.56, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride is sourced from PubChem (CID 66934082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).