1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane

C12H27N3O2S — CID 114803863

IUPAC1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane
SMILESCCN(C1(CN)CCCC1)S(=O)(=O)NC(C)(C)C
InChIInChI=1S/C12H27N3O2S/c1-5-15(12(10-13)8-6-7-9-12)18(16,17)14-11(2,3)4/h14H,5-10,13H2,1-4H3
InChIKeyCEIKGHYZCSZCNU-UHFFFAOYSA-N
MW277.43 g/mol
LogP1.21
Rot. Bonds5

About 1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane

1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane (PubChem CID 114803863) has the molecular formula C12H27N3O2S and a molecular weight of 277.43 g/mol. Its IUPAC name is 1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane.

Molecular Properties

Compound Name1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane
PubChem CID114803863
Molecular FormulaC12H27N3O2S
Molecular Weight277.43 g/mol
Exact Mass277.18
IUPAC Name1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane
SMILESCCN(C1(CN)CCCC1)S(=O)(=O)NC(C)(C)C
InChIInChI=1S/C12H27N3O2S/c1-5-15(12(10-13)8-6-7-9-12)18(16,17)14-11(2,3)4/h14H,5-10,13H2,1-4H3
InChIKeyCEIKGHYZCSZCNU-UHFFFAOYSA-N
XLogP1.21
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.43
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-1-[ethyl(sulfamoyl)amino]cyclopentane
CID 114958602
1-(aminomethyl)-1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane
CID 114803859
N-[1-(aminomethyl)cycloheptyl]-N-ethyl-2-methylpropane-2-sulfonamide
CID 63689699
N-[1-(aminomethyl)cycloheptyl]-N-ethylethanesulfonamide
CID 62009824
N-[1-(aminomethyl)cyclohexyl]-N-ethylcyclopentanesulfonamide
CID 105360481
N-[1-(aminomethyl)cyclohexyl]-2-methyl-N-propylpropane-2-sulfonamide
CID 63688957
N-[1-(aminomethyl)cyclopentyl]-1-cyclopropyl-N-ethylmethanesulfonamide
CID 64990132
1-(aminomethyl)-1-[methyl(methylsulfamoyl)amino]cyclopentane
CID 114803856
1-(aminomethyl)-1-[cyclopropylsulfamoyl(propyl)amino]cycloheptane
CID 114803852
1-(aminomethyl)-1-[cyclopropylsulfamoyl(ethyl)amino]-4-ethylcyclohexane
CID 114803828
methyl N-[[1-(aminomethyl)-3-methylcyclohexyl]-ethylsulfamoyl]carbamate
CID 114461318
N-[1-(aminomethyl)cycloheptyl]-N-propylpropane-2-sulfonamide
CID 62008030

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane?
The IUPAC name of 1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane (CID 114803863) is 1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane.
What is the SMILES notation for 1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane?
The canonical SMILES for 1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane is CCN(C1(CN)CCCC1)S(=O)(=O)NC(C)(C)C.
What is the InChIKey of 1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane?
The InChIKey is CEIKGHYZCSZCNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O2S/c1-5-15(12(10-13)8-6-7-9-12)18(16,17)14-11(2,3)4/h14H,5-10,13H2,1-4H3.
What are the key properties of 1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane?
1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane has a molecular weight of 277.43 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane is sourced from PubChem (CID 114803863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).