2-(cyclopropylsulfamoylamino)pentanimidamide

C8H18N4O2S — CID 114813356

IUPAC2-(cyclopropylsulfamoylamino)pentanimidamide
SMILES[H]/N=C(\N)C(CCC)NS(=O)(=O)NC1CC1
InChIInChI=1S/C8H18N4O2S/c1-2-3-7(8(9)10)12-15(13,14)11-6-4-5-6/h6-7,11-12H,2-5H2,1H3,(H3,9,10)
InChIKeyPCJUFJFGKHZMNP-UHFFFAOYSA-N
MW234.32 g/mol
LogP-0.32
Rot. Bonds7

About 2-(cyclopropylsulfamoylamino)pentanimidamide

2-(cyclopropylsulfamoylamino)pentanimidamide (PubChem CID 114813356) has the molecular formula C8H18N4O2S and a molecular weight of 234.32 g/mol. Its IUPAC name is 2-(cyclopropylsulfamoylamino)pentanimidamide.

Molecular Properties

Compound Name2-(cyclopropylsulfamoylamino)pentanimidamide
PubChem CID114813356
Molecular FormulaC8H18N4O2S
Molecular Weight234.32 g/mol
Exact Mass234.12
IUPAC Name2-(cyclopropylsulfamoylamino)pentanimidamide
SMILES[H]/N=C(\N)C(CCC)NS(=O)(=O)NC1CC1
InChIInChI=1S/C8H18N4O2S/c1-2-3-7(8(9)10)12-15(13,14)11-6-4-5-6/h6-7,11-12H,2-5H2,1H3,(H3,9,10)
InChIKeyPCJUFJFGKHZMNP-UHFFFAOYSA-N
XLogP-0.32
TPSA108.07 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 5-0.32
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'}

Analyze 2-(cyclopropylsulfamoylamino)pentanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylsulfamoylamino)pentanimidamide?
The IUPAC name of 2-(cyclopropylsulfamoylamino)pentanimidamide (CID 114813356) is 2-(cyclopropylsulfamoylamino)pentanimidamide.
What is the SMILES notation for 2-(cyclopropylsulfamoylamino)pentanimidamide?
The canonical SMILES for 2-(cyclopropylsulfamoylamino)pentanimidamide is [H]/N=C(\N)C(CCC)NS(=O)(=O)NC1CC1.
What is the InChIKey of 2-(cyclopropylsulfamoylamino)pentanimidamide?
The InChIKey is PCJUFJFGKHZMNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4O2S/c1-2-3-7(8(9)10)12-15(13,14)11-6-4-5-6/h6-7,11-12H,2-5H2,1H3,(H3,9,10).
What are the key properties of 2-(cyclopropylsulfamoylamino)pentanimidamide?
2-(cyclopropylsulfamoylamino)pentanimidamide has a molecular weight of 234.32 g/mol, XLogP of -0.32, 7 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylsulfamoylamino)pentanimidamide is sourced from PubChem (CID 114813356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).