N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide

C14H30N4O4S2 — CID 167795826

IUPACN-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide
SMILESCCN(C)S(=O)(=O)NCC1CC12CCN(S(=O)(=O)N(C)CC)CC2
InChIInChI=1S/C14H30N4O4S2/c1-5-16(3)23(19,20)15-12-13-11-14(13)7-9-18(10-8-14)24(21,22)17(4)6-2/h13,15H,5-12H2,1-4H3
InChIKeyHJMRCUCFNMQHHO-UHFFFAOYSA-N
MW382.55 g/mol
LogP0.07
Rot. Bonds8

About N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide

N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide (PubChem CID 167795826) has the molecular formula C14H30N4O4S2 and a molecular weight of 382.55 g/mol. Its IUPAC name is N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide.

Molecular Properties

Compound NameN-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide
PubChem CID167795826
Molecular FormulaC14H30N4O4S2
Molecular Weight382.55 g/mol
Exact Mass382.17
IUPAC NameN-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide
SMILESCCN(C)S(=O)(=O)NCC1CC12CCN(S(=O)(=O)N(C)CC)CC2
InChIInChI=1S/C14H30N4O4S2/c1-5-16(3)23(19,20)15-12-13-11-14(13)7-9-18(10-8-14)24(21,22)17(4)6-2/h13,15H,5-12H2,1-4H3
InChIKeyHJMRCUCFNMQHHO-UHFFFAOYSA-N
XLogP0.07
TPSA90.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.55
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-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

3-(aminomethyl)-N-ethyl-N,3-dimethylpyrrolidine-1-sulfonamide
CID 120778042
N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide
CID 119977585
N-ethyl-N-methylthiomorpholine-4-sulfonamide
CID 58831796
N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride
CID 119977584
4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride
CID 119963738
4-[[[ethyl(methyl)sulfamoyl]amino]methyl]-1-[(E)-2-methylpent-2-enyl]piperidine
CID 56757093
(3S)-1-cycloheptyl-3-[[[ethyl(methyl)sulfamoyl]amino]methyl]pyrrolidine
CID 95212661
4-[[[ethyl(methyl)sulfamoyl]amino]methyl]-1-[(2-methylphenyl)methyl]piperidine
CID 56745274
N-[(6-methyl-6-azaspiro[2.5]octan-2-yl)methyl]ethanamine
CID 130138088
(3aS,6aR)-N-ethyl-N-methyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole-5-sulfonamide;hydrochloride
CID 120665253
N-[(6-methyl-6-azaspiro[2.5]octan-2-yl)methyl]formamide
CID 154671249
4-amino-N-methyl-N-propylpiperidine-1-sulfonamide
CID 119958974

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide?
The IUPAC name of N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide (CID 167795826) is N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide.
What is the SMILES notation for N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide?
The canonical SMILES for N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide is CCN(C)S(=O)(=O)NCC1CC12CCN(S(=O)(=O)N(C)CC)CC2.
What is the InChIKey of N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide?
The InChIKey is HJMRCUCFNMQHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N4O4S2/c1-5-16(3)23(19,20)15-12-13-11-14(13)7-9-18(10-8-14)24(21,22)17(4)6-2/h13,15H,5-12H2,1-4H3.
What are the key properties of N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide?
N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide has a molecular weight of 382.55 g/mol, XLogP of 0.07, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[[ethyl(methyl)sulfamoyl]amino]methyl]-N-methyl-6-azaspiro[2.5]octane-6-sulfonamide is sourced from PubChem (CID 167795826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).