N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide

C12H22N4O2S — CID 62374937

IUPACN-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide
SMILESCn1cnc(S(=O)(=O)N(CCCN)C2CCCC2)c1
InChIInChI=1S/C12H22N4O2S/c1-15-9-12(14-10-15)19(17,18)16(8-4-7-13)11-5-2-3-6-11/h9-11H,2-8,13H2,1H3
InChIKeyHVPVAORPBSBXJZ-UHFFFAOYSA-N
MW286.40 g/mol
LogP0.70
Rot. Bonds6

About N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide

N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide (PubChem CID 62374937) has the molecular formula C12H22N4O2S and a molecular weight of 286.40 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide
PubChem CID62374937
Molecular FormulaC12H22N4O2S
Molecular Weight286.40 g/mol
Exact Mass286.15
IUPAC NameN-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide
SMILESCn1cnc(S(=O)(=O)N(CCCN)C2CCCC2)c1
InChIInChI=1S/C12H22N4O2S/c1-15-9-12(14-10-15)19(17,18)16(8-4-7-13)11-5-2-3-6-11/h9-11H,2-8,13H2,1H3
InChIKeyHVPVAORPBSBXJZ-UHFFFAOYSA-N
XLogP0.70
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-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

1H-Imidazole-4-sulfonamide, 1-(1-methylethyl)-
CID 71757215
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
(3aR,6aS)-4-(1-methylimidazol-4-yl)sulfonyl-1-(2-methylpropyl)-2,3,3a,5,6,6a-hexahydropyrrolo[3,2-b]pyrrole
CID 97458869
1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidin-4-amine dihydrochloride
CID 165943498
N-[1-(aminomethyl)cyclopentyl]-1-methylimidazole-4-sulfonamide
CID 62373927
N-(2-amino-2-ethylbutyl)-1-methylimidazole-4-sulfonamide
CID 84591328
N-[3-(methylamino)propyl]-1-propan-2-ylimidazole-4-sulfonamide
CID 84598067
N-(piperidin-2-ylmethyl)-1-propan-2-ylimidazole-4-sulfonamide
CID 86784600
N-[(1-ethylpyrrolidin-2-yl)methyl]-1-propan-2-ylimidazole-4-sulfonamide
CID 86801792
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-sulfonamide
CID 100628334
3-ethyl-N-methyl-N-(1-methylcyclopentyl)imidazole-4-sulfonamide
CID 137955579

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide (CID 62374937) is N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide is Cn1cnc(S(=O)(=O)N(CCCN)C2CCCC2)c1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide?
The InChIKey is HVPVAORPBSBXJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2S/c1-15-9-12(14-10-15)19(17,18)16(8-4-7-13)11-5-2-3-6-11/h9-11H,2-8,13H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide?
N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide has a molecular weight of 286.40 g/mol, XLogP of 0.70, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide is sourced from PubChem (CID 62374937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).