2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide

C7H16N4O2S — CID 114813178

IUPAC2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide
SMILES[H]/N=C(\N)C(C)(C)NS(=O)(=O)NC1CC1
InChIInChI=1S/C7H16N4O2S/c1-7(2,6(8)9)11-14(12,13)10-5-3-4-5/h5,10-11H,3-4H2,1-2H3,(H3,8,9)
InChIKeyQEWMZPQPLAXSTE-UHFFFAOYSA-N
MW220.30 g/mol
LogP-0.71
Rot. Bonds5

About 2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide

2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide (PubChem CID 114813178) has the molecular formula C7H16N4O2S and a molecular weight of 220.30 g/mol. Its IUPAC name is 2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide.

Molecular Properties

Compound Name2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide
PubChem CID114813178
Molecular FormulaC7H16N4O2S
Molecular Weight220.30 g/mol
Exact Mass220.10
IUPAC Name2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide
SMILES[H]/N=C(\N)C(C)(C)NS(=O)(=O)NC1CC1
InChIInChI=1S/C7H16N4O2S/c1-7(2,6(8)9)11-14(12,13)10-5-3-4-5/h5,10-11H,3-4H2,1-2H3,(H3,8,9)
InChIKeyQEWMZPQPLAXSTE-UHFFFAOYSA-N
XLogP-0.71
TPSA108.07 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 5-0.71
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-Methyl-2-[[methyl(propan-2-yl)sulfamoyl]amino]propanimidamide
CID 64408759
2-(cyclopropylsulfamoylamino)-N'-hydroxy-2-methylpropanimidamide
CID 104978287
N'-hydroxy-2-methyl-2-(propan-2-ylsulfamoylamino)propanimidamide
CID 104978292
2-(cyclopropylsulfamoylamino)-N'-hydroxy-2-methylbutanimidamide
CID 104978341
3-(Cyclopropylsulfamoylamino)butanimidamide
CID 114813149
2-Methyl-2-(propan-2-ylsulfamoylamino)propanimidamide
CID 114813177
2-Methyl-2-(methylsulfamoylamino)propanimidamide
CID 114813179
2-(Ethylsulfamoylamino)-2-methylpropanimidamide
CID 114813182
2-Methyl-2-(propylsulfamoylamino)propanimidamide
CID 114813183
3-(Tert-butylsulfamoylamino)propanimidamide
CID 114813210
2-(Cyclopropylsulfamoylamino)ethanimidamide
CID 114813245
2-(Tert-butylsulfamoylamino)ethanimidamide
CID 114813248

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide?
The IUPAC name of 2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide (CID 114813178) is 2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide.
What is the SMILES notation for 2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide?
The canonical SMILES for 2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide is [H]/N=C(\N)C(C)(C)NS(=O)(=O)NC1CC1.
What is the InChIKey of 2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide?
The InChIKey is QEWMZPQPLAXSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N4O2S/c1-7(2,6(8)9)11-14(12,13)10-5-3-4-5/h5,10-11H,3-4H2,1-2H3,(H3,8,9).
What are the key properties of 2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide?
2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide has a molecular weight of 220.30 g/mol, XLogP of -0.71, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylsulfamoylamino)-2-methylpropanimidamide is sourced from PubChem (CID 114813178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).