N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide

C8H20N2O2S — CID 97237986

IUPACN-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide
SMILESCC(C)C[C@](C)(CN)NS(C)(=O)=O
InChIInChI=1S/C8H20N2O2S/c1-7(2)5-8(3,6-9)10-13(4,11)12/h7,10H,5-6,9H2,1-4H3/t8-/m1/s1
InChIKeyJOBBARVBCMDCDV-MRVPVSSYSA-N
MW208.33 g/mol
LogP0.30
Rot. Bonds5

About N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide

N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide (PubChem CID 97237986) has the molecular formula C8H20N2O2S and a molecular weight of 208.33 g/mol. Its IUPAC name is N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide
PubChem CID97237986
Molecular FormulaC8H20N2O2S
Molecular Weight208.33 g/mol
Exact Mass208.12
IUPAC NameN-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide
SMILESCC(C)C[C@](C)(CN)NS(C)(=O)=O
InChIInChI=1S/C8H20N2O2S/c1-7(2)5-8(3,6-9)10-13(4,11)12/h7,10H,5-6,9H2,1-4H3/t8-/m1/s1
InChIKeyJOBBARVBCMDCDV-MRVPVSSYSA-N
XLogP0.30
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.33
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-2,4-dimethyl-2-(sulfamoylamino)pentane
CID 114959433
N-(1-amino-2,4-dimethylpentan-2-yl)ethanesulfonamide;hydrochloride
CID 119985245
2,4-dimethyl-2-N-(methylsulfamoyl)pentane-1,2-diamine
CID 114811263
1-amino-2,4-dimethyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]pentane;hydrochloride
CID 119985049
N-(1-amino-2,4-dimethylpentan-2-yl)-2-bromobenzenesulfonamide;hydrochloride
CID 119985372
N-(1-amino-2,4-dimethylpentan-2-yl)benzenesulfonamide;hydrochloride
CID 84591010
N-(1-amino-2,4-dimethylpentan-2-yl)-2-methylpentane-1-sulfonamide;hydrochloride
CID 119985236
N-(1-amino-2,4-dimethylpentan-2-yl)-1-phenylmethanesulfonamide
CID 115309921
N-(1-amino-2,4-dimethylpentan-2-yl)-2,4,5-trifluorobenzenesulfonamide
CID 119985170
N-(1-amino-2,4-dimethylpentan-2-yl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride
CID 119998499
ethyl 3-[(1-amino-2,4-dimethylpentan-2-yl)sulfamoyl]propanoate
CID 115310020
N-(1-amino-2,4-dimethylpentan-2-yl)-2,4,6-trichlorobenzenesulfonamide
CID 115310018

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide?
The IUPAC name of N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide (CID 97237986) is N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide.
What is the SMILES notation for N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide?
The canonical SMILES for N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide is CC(C)C[C@](C)(CN)NS(C)(=O)=O.
What is the InChIKey of N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide?
The InChIKey is JOBBARVBCMDCDV-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H20N2O2S/c1-7(2)5-8(3,6-9)10-13(4,11)12/h7,10H,5-6,9H2,1-4H3/t8-/m1/s1.
What are the key properties of N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide?
N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide has a molecular weight of 208.33 g/mol, XLogP of 0.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-amino-2,4-dimethylpentan-2-yl]methanesulfonamide is sourced from PubChem (CID 97237986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).