5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane

C7H19N3O2S — CID 106141921

IUPAC5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane
SMILESCC(C)(CCCN)CNS(N)(=O)=O
InChIInChI=1S/C7H19N3O2S/c1-7(2,4-3-5-8)6-10-13(9,11)12/h10H,3-6,8H2,1-2H3,(H2,9,11,12)
InChIKeyYBTMPPQFYAZSFK-UHFFFAOYSA-N
MW209.31 g/mol
LogP-0.46
Rot. Bonds6

About 5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane

5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane (PubChem CID 106141921) has the molecular formula C7H19N3O2S and a molecular weight of 209.31 g/mol. Its IUPAC name is 5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane.

Molecular Properties

Compound Name5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane
PubChem CID106141921
Molecular FormulaC7H19N3O2S
Molecular Weight209.31 g/mol
Exact Mass209.12
IUPAC Name5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane
SMILESCC(C)(CCCN)CNS(N)(=O)=O
InChIInChI=1S/C7H19N3O2S/c1-7(2,4-3-5-8)6-10-13(9,11)12/h10H,3-6,8H2,1-2H3,(H2,9,11,12)
InChIKeyYBTMPPQFYAZSFK-UHFFFAOYSA-N
XLogP-0.46
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,4-dimethylpentyl)sulfamoyl fluoride
CID 59881111
2,2-dimethyl-N-(2,2,2-trifluoroethylsulfamoyl)pentane-1,5-diamine
CID 114149107
2,4,4-trimethyl-N-(2,4,4-trimethylpentylsulfamoyl)pentan-1-amine
CID 20240475
3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine
CID 20706577
2,4,4-Trimethyl-1-(sulfinatoamino)pentane
CID 57421733
3,3-Dimethyl-1-(sulfamoylamino)butane
CID 57664623
N-(3,3-dimethylbutyl)sulfamate
CID 59847904
4-Methyl-1-(sulfamoylamino)pentane
CID 59849306
N-(methylsulfamoyl)pentan-1-amine
CID 84284145
4,4-Dimethylpentylsulfamic acid
CID 87283508
5,5-Dimethylhexylsulfamic acid
CID 87283510
Azane;1-(sulfamoylamino)pentane
CID 87509026

Frequently Asked Questions

What is the IUPAC name of 5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane?
The IUPAC name of 5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane (CID 106141921) is 5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane.
What is the SMILES notation for 5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane?
The canonical SMILES for 5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane is CC(C)(CCCN)CNS(N)(=O)=O.
What is the InChIKey of 5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane?
The InChIKey is YBTMPPQFYAZSFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3O2S/c1-7(2,4-3-5-8)6-10-13(9,11)12/h10H,3-6,8H2,1-2H3,(H2,9,11,12).
What are the key properties of 5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane?
5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane has a molecular weight of 209.31 g/mol, XLogP of -0.46, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2,2-dimethyl-1-(sulfamoylamino)pentane is sourced from PubChem (CID 106141921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).