1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine

C15H26N4O2S — CID 70723721

IUPAC1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine
SMILESCn1cnc(S(=O)(=O)N2CCCCC2CCN2CCCC2)c1
InChIInChI=1S/C15H26N4O2S/c1-17-12-15(16-13-17)22(20,21)19-10-3-2-6-14(19)7-11-18-8-4-5-9-18/h12-14H,2-11H2,1H3
InChIKeyMYIDQHPMYXMFFN-UHFFFAOYSA-N
MW326.47 g/mol
LogP1.45
Rot. Bonds5

About 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine

1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine (PubChem CID 70723721) has the molecular formula C15H26N4O2S and a molecular weight of 326.47 g/mol. Its IUPAC name is 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine.

Molecular Properties

Compound Name1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine
PubChem CID70723721
Molecular FormulaC15H26N4O2S
Molecular Weight326.47 g/mol
Exact Mass326.18
IUPAC Name1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine
SMILESCn1cnc(S(=O)(=O)N2CCCCC2CCN2CCCC2)c1
InChIInChI=1S/C15H26N4O2S/c1-17-12-15(16-13-17)22(20,21)19-10-3-2-6-14(19)7-11-18-8-4-5-9-18/h12-14H,2-11H2,1H3
InChIKeyMYIDQHPMYXMFFN-UHFFFAOYSA-N
XLogP1.45
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.47
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine 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

4-methyl-1'-((1-methyl-1H-imidazol-4-yl)sulfonyl)-1,4'-bipiperidine
CID 118308389
1-butan-2-yl-N,N-dimethylimidazole-4-sulfonamide
CID 71969893
2-(1,2-Dimethylimidazol-4-yl)sulfonyl-2-azaspiro[4.5]decane
CID 71997293
7-Ethyl-2-(1-methylimidazol-4-yl)sulfonyl-2,7-diazaspiro[3.4]octane
CID 97392923
(3aR,6aS)-4-(1-methylimidazol-4-yl)sulfonyl-1-(2-methylpropyl)-2,3,3a,5,6,6a-hexahydropyrrolo[3,2-b]pyrrole
CID 97458869
2-(1-Methylimidazol-4-yl)sulfonyl-7-(2-methylpropyl)-2,7-diazaspiro[3.4]octane
CID 97472658
1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidin-4-amine dihydrochloride
CID 165943498
1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]-4-(1H-1,2,3-triazol-1-yl)piperidine
CID 76151030
1-isopropyl-N-(8-(methylsulfonyl)-8-azabicyclo[3.2.1]octan-3-yl)-1H-imidazole-4-sulfonamide
CID 86265062
1-((1-isopropyl-1H-imidazol-4-yl)sulfonyl)-4-((1-methyl-1H-imidazol-2-yl)sulfonyl)piperidine
CID 91625066
N-[3-(methylamino)propyl]-1-propan-2-ylimidazole-4-sulfonamide
CID 84598067
N-(piperidin-2-ylmethyl)-1-propan-2-ylimidazole-4-sulfonamide
CID 86784600

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine?
The IUPAC name of 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine (CID 70723721) is 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine.
What is the SMILES notation for 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine?
The canonical SMILES for 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine is Cn1cnc(S(=O)(=O)N2CCCCC2CCN2CCCC2)c1.
What is the InChIKey of 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine?
The InChIKey is MYIDQHPMYXMFFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O2S/c1-17-12-15(16-13-17)22(20,21)19-10-3-2-6-14(19)7-11-18-8-4-5-9-18/h12-14H,2-11H2,1H3.
What are the key properties of 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine?
1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine has a molecular weight of 326.47 g/mol, XLogP of 1.45, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylimidazol-4-yl)sulfonyl-2-(2-pyrrolidin-1-ylethyl)piperidine is sourced from PubChem (CID 70723721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).