3-(cyclopropylsulfamoylamino)propanimidamide

C6H14N4O2S — CID 114813207

IUPAC3-(cyclopropylsulfamoylamino)propanimidamide
SMILES[H]/N=C(\N)CCNS(=O)(=O)NC1CC1
InChIInChI=1S/C6H14N4O2S/c7-6(8)3-4-9-13(11,12)10-5-1-2-5/h5,9-10H,1-4H2,(H3,7,8)
InChIKeyDRTFRVRUXDYUKA-UHFFFAOYSA-N
MW206.27 g/mol
LogP-1.10
Rot. Bonds6

About 3-(cyclopropylsulfamoylamino)propanimidamide

3-(cyclopropylsulfamoylamino)propanimidamide (PubChem CID 114813207) has the molecular formula C6H14N4O2S and a molecular weight of 206.27 g/mol. Its IUPAC name is 3-(cyclopropylsulfamoylamino)propanimidamide.

Molecular Properties

Compound Name3-(cyclopropylsulfamoylamino)propanimidamide
PubChem CID114813207
Molecular FormulaC6H14N4O2S
Molecular Weight206.27 g/mol
Exact Mass206.08
IUPAC Name3-(cyclopropylsulfamoylamino)propanimidamide
SMILES[H]/N=C(\N)CCNS(=O)(=O)NC1CC1
InChIInChI=1S/C6H14N4O2S/c7-6(8)3-4-9-13(11,12)10-5-1-2-5/h5,9-10H,1-4H2,(H3,7,8)
InChIKeyDRTFRVRUXDYUKA-UHFFFAOYSA-N
XLogP-1.10
TPSA108.07 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 5-1.10
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

3-[[Methyl(propan-2-yl)sulfamoyl]amino]propanimidamide
CID 64406691
3-(cyclopropylsulfamoylamino)-N'-hydroxypropanimidamide
CID 104978421
3-(Propan-2-ylsulfamoylamino)butanimidamide
CID 114813148
3-(Cyclopropylsulfamoylamino)butanimidamide
CID 114813149
3-(Methylsulfamoylamino)butanimidamide
CID 114813150
3-(Ethylsulfamoylamino)butanimidamide
CID 114813153
3-(Propylsulfamoylamino)butanimidamide
CID 114813154
3-(Propan-2-ylsulfamoylamino)propanimidamide
CID 114813206
3-(Methylsulfamoylamino)propanimidamide
CID 114813208
3-(Ethylsulfamoylamino)propanimidamide
CID 114813211
3-(Propylsulfamoylamino)propanimidamide
CID 114813212
2-(Propan-2-ylsulfamoylamino)ethanimidamide
CID 114813244

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylsulfamoylamino)propanimidamide?
The IUPAC name of 3-(cyclopropylsulfamoylamino)propanimidamide (CID 114813207) is 3-(cyclopropylsulfamoylamino)propanimidamide.
What is the SMILES notation for 3-(cyclopropylsulfamoylamino)propanimidamide?
The canonical SMILES for 3-(cyclopropylsulfamoylamino)propanimidamide is [H]/N=C(\N)CCNS(=O)(=O)NC1CC1.
What is the InChIKey of 3-(cyclopropylsulfamoylamino)propanimidamide?
The InChIKey is DRTFRVRUXDYUKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N4O2S/c7-6(8)3-4-9-13(11,12)10-5-1-2-5/h5,9-10H,1-4H2,(H3,7,8).
What are the key properties of 3-(cyclopropylsulfamoylamino)propanimidamide?
3-(cyclopropylsulfamoylamino)propanimidamide has a molecular weight of 206.27 g/mol, XLogP of -1.10, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylsulfamoylamino)propanimidamide is sourced from PubChem (CID 114813207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).