N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide

C10H18N4O2S — CID 113295210

IUPACN-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide
SMILESNCC1(CNS(=O)(=O)c2cnc[nH]2)CCCC1
InChIInChI=1S/C10H18N4O2S/c11-6-10(3-1-2-4-10)7-14-17(15,16)9-5-12-8-13-9/h5,8,14H,1-4,6-7,11H2,(H,12,13)
InChIKeyDAJXLHGEMMHICC-UHFFFAOYSA-N
MW258.35 g/mol
LogP0.21
Rot. Bonds5

About N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide

N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide (PubChem CID 113295210) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide
PubChem CID113295210
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC NameN-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide
SMILESNCC1(CNS(=O)(=O)c2cnc[nH]2)CCCC1
InChIInChI=1S/C10H18N4O2S/c11-6-10(3-1-2-4-10)7-14-17(15,16)9-5-12-8-13-9/h5,8,14H,1-4,6-7,11H2,(H,12,13)
InChIKeyDAJXLHGEMMHICC-UHFFFAOYSA-N
XLogP0.21
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 50.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(hydroxymethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide
CID 115361933
N-[(4-hydroxyoxan-4-yl)methyl]-1H-imidazole-5-sulfonamide
CID 81131168
N-(1-ethylcyclobutyl)-1H-imidazole-5-sulfonamide
CID 115673541
N-[2-(aminomethyl)-2-ethylbutyl]-1H-imidazole-5-sulfonamide
CID 106251055
N-[[1-(aminomethyl)cyclopentyl]methyl]-2-methyl-1-propylimidazole-4-sulfonamide
CID 115365860
N-(2,2-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide
CID 79872664
N-[[1-(aminomethyl)cyclopentyl]methyl]-3,4-dimethylbenzenesulfonamide
CID 115365882
N-[[1-(aminomethyl)cyclohexyl]methyl]-1-ethylimidazole-4-sulfonamide
CID 103970327
N-[(1-ethylcyclopentyl)methyl]-2-methyl-1H-imidazole-5-sulfonamide
CID 103908553
N-[3-(methanesulfonamido)propyl]-1H-imidazole-5-sulfonamide
CID 103680413
N-(4-bromobutyl)-1H-imidazole-5-sulfonamide
CID 106846730
N-[[1-(aminomethyl)cyclobutyl]methyl]-2-bromobenzenesulfonamide
CID 115271965

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide?
The IUPAC name of N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide (CID 113295210) is N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide is NCC1(CNS(=O)(=O)c2cnc[nH]2)CCCC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide?
The InChIKey is DAJXLHGEMMHICC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c11-6-10(3-1-2-4-10)7-14-17(15,16)9-5-12-8-13-9/h5,8,14H,1-4,6-7,11H2,(H,12,13).
What are the key properties of N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide?
N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide has a molecular weight of 258.35 g/mol, XLogP of 0.21, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclopentyl]methyl]-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 113295210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).