4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine

C14H24N4O3S — CID 124885146

IUPAC4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine
SMILESO=S(=O)([C@@H]1CCCN(CCn2ccnc2)C1)N1CCOCC1
InChIInChI=1S/C14H24N4O3S/c19-22(20,18-8-10-21-11-9-18)14-2-1-4-16(12-14)6-7-17-5-3-15-13-17/h3,5,13-14H,1-2,4,6-12H2/t14-/m1/s1
InChIKeyOLOQMJLMCVXTSJ-CQSZACIVSA-N
MW328.44 g/mol
LogP0.01
Rot. Bonds5

About 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine

4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine (PubChem CID 124885146) has the molecular formula C14H24N4O3S and a molecular weight of 328.44 g/mol. Its IUPAC name is 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine.

Molecular Properties

Compound Name4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine
PubChem CID124885146
Molecular FormulaC14H24N4O3S
Molecular Weight328.44 g/mol
Exact Mass328.16
IUPAC Name4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine
SMILESO=S(=O)([C@@H]1CCCN(CCn2ccnc2)C1)N1CCOCC1
InChIInChI=1S/C14H24N4O3S/c19-22(20,18-8-10-21-11-9-18)14-2-1-4-16(12-14)6-7-17-5-3-15-13-17/h3,5,13-14H,1-2,4,6-12H2/t14-/m1/s1
InChIKeyOLOQMJLMCVXTSJ-CQSZACIVSA-N
XLogP0.01
TPSA67.67 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 50.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine 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

(3S)-N-cyclopentyl-1-(2-imidazol-1-ylethyl)piperidine-3-sulfonamide
CID 124616926
1-(2-pyrrolidin-1-ylethyl)imidazole
CID 19964498
1-[1-(2-imidazol-1-ylethyl)piperidin-3-yl]ethanamine
CID 63848734
(3R)-1-(2-imidazol-1-ylethyl)pyrrolidin-3-amine
CID 94340676
1-cyclohexyl-4-[1-(2-imidazol-1-ylethyl)azetidin-3-yl]piperazine
CID 126892681
(3aR,5R,6R,7aS)-2-(3-imidazol-1-ylpropyl)-6-morpholin-4-yl-1,3,3a,4,5,6,7,7a-octahydroisoindol-5-ol
CID 172655812
4-[(3S)-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]sulfonylmorpholine
CID 124885316
[1-(2-imidazol-1-ylethyl)pyrrolidin-3-yl]methanamine
CID 61462956
[4-(2-imidazol-1-ylethyl)morpholin-2-yl]methanamine
CID 112703863
2-[4-(2-imidazol-1-ylethyl)morpholin-2-yl]acetic acid
CID 66434098
[1-(3-imidazol-1-ylpropyl)piperidin-3-yl]methanamine
CID 61493085
3-(aminomethyl)-N-(2-imidazol-1-ylethyl)piperidine-1-sulfonamide
CID 106018056

Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine?
The IUPAC name of 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine (CID 124885146) is 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine.
What is the SMILES notation for 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine?
The canonical SMILES for 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine is O=S(=O)([C@@H]1CCCN(CCn2ccnc2)C1)N1CCOCC1.
What is the InChIKey of 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine?
The InChIKey is OLOQMJLMCVXTSJ-CQSZACIVSA-N. The full InChI is InChI=1S/C14H24N4O3S/c19-22(20,18-8-10-21-11-9-18)14-2-1-4-16(12-14)6-7-17-5-3-15-13-17/h3,5,13-14H,1-2,4,6-12H2/t14-/m1/s1.
What are the key properties of 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine?
4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine has a molecular weight of 328.44 g/mol, XLogP of 0.01, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-1-(2-imidazol-1-ylethyl)piperidin-3-yl]sulfonylmorpholine is sourced from PubChem (CID 124885146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).