[(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane

C9H21N3O2S — CID 99835144

IUPAC[(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane
SMILESCN(C)S(=O)(=O)N[C@@H](CN)C1CCCC1
InChIInChI=1S/C9H21N3O2S/c1-12(2)15(13,14)11-9(7-10)8-5-3-4-6-8/h8-9,11H,3-7,10H2,1-2H3/t9-/m0/s1
InChIKeyQAMAHEVLHPWPQF-VIFPVBQESA-N
MW235.35 g/mol
LogP-0.10
Rot. Bonds5

About [(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane

[(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane (PubChem CID 99835144) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is [(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane.

Molecular Properties

Compound Name[(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane
PubChem CID99835144
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC Name[(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane
SMILESCN(C)S(=O)(=O)N[C@@H](CN)C1CCCC1
InChIInChI=1S/C9H21N3O2S/c1-12(2)15(13,14)11-9(7-10)8-5-3-4-6-8/h8-9,11H,3-7,10H2,1-2H3/t9-/m0/s1
InChIKeyQAMAHEVLHPWPQF-VIFPVBQESA-N
XLogP-0.10
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane?
The IUPAC name of [(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane (CID 99835144) is [(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane.
What is the SMILES notation for [(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane?
The canonical SMILES for [(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane is CN(C)S(=O)(=O)N[C@@H](CN)C1CCCC1.
What is the InChIKey of [(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane?
The InChIKey is QAMAHEVLHPWPQF-VIFPVBQESA-N. The full InChI is InChI=1S/C9H21N3O2S/c1-12(2)15(13,14)11-9(7-10)8-5-3-4-6-8/h8-9,11H,3-7,10H2,1-2H3/t9-/m0/s1.
What are the key properties of [(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane?
[(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane has a molecular weight of 235.35 g/mol, XLogP of -0.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-2-amino-1-(dimethylsulfamoylamino)ethyl]cyclopentane is sourced from PubChem (CID 99835144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).