3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine

C10H18N4O2S — CID 81457675

IUPAC3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine
SMILESCCC1CN(S(=O)(=O)c2cnc[nH]2)CCC1N
InChIInChI=1S/C10H18N4O2S/c1-2-8-6-14(4-3-9(8)11)17(15,16)10-5-12-7-13-10/h5,7-9H,2-4,6,11H2,1H3,(H,12,13)
InChIKeyWFOVIOACSWWJET-UHFFFAOYSA-N
MW258.35 g/mol
LogP0.16
Rot. Bonds3

About 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine

3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine (PubChem CID 81457675) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine.

Molecular Properties

Compound Name3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine
PubChem CID81457675
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC Name3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine
SMILESCCC1CN(S(=O)(=O)c2cnc[nH]2)CCC1N
InChIInChI=1S/C10H18N4O2S/c1-2-8-6-14(4-3-9(8)11)17(15,16)10-5-12-7-13-10/h5,7-9H,2-4,6,11H2,1H3,(H,12,13)
InChIKeyWFOVIOACSWWJET-UHFFFAOYSA-N
XLogP0.16
TPSA92.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine 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 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine?
The IUPAC name of 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine (CID 81457675) is 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine.
What is the SMILES notation for 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine?
The canonical SMILES for 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine is CCC1CN(S(=O)(=O)c2cnc[nH]2)CCC1N.
What is the InChIKey of 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine?
The InChIKey is WFOVIOACSWWJET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-2-8-6-14(4-3-9(8)11)17(15,16)10-5-12-7-13-10/h5,7-9H,2-4,6,11H2,1H3,(H,12,13).
What are the key properties of 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine?
3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine has a molecular weight of 258.35 g/mol, XLogP of 0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(1H-imidazol-5-ylsulfonyl)piperidin-4-amine is sourced from PubChem (CID 81457675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).