N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide

C10H18N4O2S — CID 62008228

IUPACN-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide
SMILESCN(C1(CN)CCCC1)S(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C10H18N4O2S/c1-14(10(8-11)4-2-3-5-10)17(15,16)9-6-12-13-7-9/h6-7H,2-5,8,11H2,1H3,(H,12,13)
InChIKeyGXSMFCPEHXEQFT-UHFFFAOYSA-N
MW258.35 g/mol
LogP0.30
Rot. Bonds4

About N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide

N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide (PubChem CID 62008228) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide
PubChem CID62008228
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide
SMILESCN(C1(CN)CCCC1)S(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C10H18N4O2S/c1-14(10(8-11)4-2-3-5-10)17(15,16)9-6-12-13-7-9/h6-7H,2-5,8,11H2,1H3,(H,12,13)
InChIKeyGXSMFCPEHXEQFT-UHFFFAOYSA-N
XLogP0.30
TPSA92.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(aminomethyl)cyclohexyl]-4-fluoro-N-methylbenzenesulfonamide
CID 62007612
N-[1-(aminomethyl)cyclopentyl]-N,4-dimethylbenzenesulfonamide
CID 62008627
N-(cyclobutylmethyl)-N-methyl-1H-pyrazole-4-sulfonamide
CID 62855891
N-[1-(aminomethyl)cyclohexyl]-N,1,2-trimethylimidazole-4-sulfonamide
CID 62062769
1-(aminomethyl)-N-(dimethylsulfamoyl)-N-methylcyclopentan-1-amine
CID 62009826
N-[[4-(dimethylamino)-1-methylpiperidin-4-yl]methyl]-1H-pyrazole-4-sulfonamide
CID 131924506
N-butan-2-yl-N-methyl-1H-pyrazole-4-sulfonamide
CID 60916490
1-(aminomethyl)-1-[methyl(methylsulfamoyl)amino]cyclopentane
CID 114803856
N-(1-methylcyclopentyl)-1H-pyrazole-4-sulfonamide
CID 47377357
N-[1-(aminomethyl)cyclobutyl]-2-fluoro-N-methylbenzenesulfonamide
CID 167982152
N-methyl-N-(2-methylprop-2-enyl)-1H-pyrazole-4-sulfonamide
CID 115967817
N-(2-amino-3-methoxypropyl)-N-methyl-1H-pyrazole-4-sulfonamide
CID 63766211

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide (CID 62008228) is N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide is CN(C1(CN)CCCC1)S(=O)(=O)c1cn[nH]c1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide?
The InChIKey is GXSMFCPEHXEQFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-14(10(8-11)4-2-3-5-10)17(15,16)9-6-12-13-7-9/h6-7H,2-5,8,11H2,1H3,(H,12,13).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide?
N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide has a molecular weight of 258.35 g/mol, XLogP of 0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-N-methyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 62008228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).