1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide

C13H24N4O2S — CID 79373627

IUPAC1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide
SMILESCCCN(C1CCCNC1)S(=O)(=O)c1cn(CC)cn1
InChIInChI=1S/C13H24N4O2S/c1-3-8-17(12-6-5-7-14-9-12)20(18,19)13-10-16(4-2)11-15-13/h10-12,14H,3-9H2,1-2H3
InChIKeyFMUUKJNOAPPNPB-UHFFFAOYSA-N
MW300.43 g/mol
LogP1.06
Rot. Bonds6

About 1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide

1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide (PubChem CID 79373627) has the molecular formula C13H24N4O2S and a molecular weight of 300.43 g/mol. Its IUPAC name is 1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide.

Molecular Properties

Compound Name1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide
PubChem CID79373627
Molecular FormulaC13H24N4O2S
Molecular Weight300.43 g/mol
Exact Mass300.16
IUPAC Name1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide
SMILESCCCN(C1CCCNC1)S(=O)(=O)c1cn(CC)cn1
InChIInChI=1S/C13H24N4O2S/c1-3-8-17(12-6-5-7-14-9-12)20(18,19)13-10-16(4-2)11-15-13/h10-12,14H,3-9H2,1-2H3
InChIKeyFMUUKJNOAPPNPB-UHFFFAOYSA-N
XLogP1.06
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.43
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-ethyl-N-piperidin-3-yl-N-propylimidazole-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

Related Compounds

N-cyclobutyl-1-ethyl-N-(3-hydroxypropyl)imidazole-4-sulfonamide
CID 102847487
N-piperidin-3-yl-N-propylethanesulfonamide
CID 60806396
N,1-diethyl-2-methyl-N-piperidin-3-ylimidazole-4-sulfonamide
CID 62064079
4-methyl-N-piperidin-3-yl-N-propylbenzenesulfonamide
CID 60806542
3,4-dichloro-N-piperidin-3-yl-N-propylbenzenesulfonamide
CID 63637983
N-(2-chloroethyl)-1-ethyl-N-propylimidazole-4-sulfonamide
CID 79372708
1-ethyl-N-[(3S,4S)-4-hydroxypyrrolidin-3-yl]-N-methylimidazole-4-sulfonamide
CID 114088856
1-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazole-4-sulfonamide
CID 79373044
1-methyl-N-propyl-N-pyrrolidin-3-ylpyrazole-4-sulfonamide
CID 62062782
1-ethyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)imidazole-4-sulfonamide
CID 106607858
N-(azetidin-3-yl)-1,2-dimethyl-N-propylimidazole-4-sulfonamide
CID 66215276
1-ethyl-N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)imidazole-4-sulfonamide
CID 106610075

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide?
The IUPAC name of 1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide (CID 79373627) is 1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide.
What is the SMILES notation for 1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide?
The canonical SMILES for 1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide is CCCN(C1CCCNC1)S(=O)(=O)c1cn(CC)cn1.
What is the InChIKey of 1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide?
The InChIKey is FMUUKJNOAPPNPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2S/c1-3-8-17(12-6-5-7-14-9-12)20(18,19)13-10-16(4-2)11-15-13/h10-12,14H,3-9H2,1-2H3.
What are the key properties of 1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide?
1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide has a molecular weight of 300.43 g/mol, XLogP of 1.06, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-piperidin-3-yl-N-propylimidazole-4-sulfonamide is sourced from PubChem (CID 79373627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).