N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide

C8H16FN3 — CID 130900508

IUPACN-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide
SMILESCCC/N=C(\NN)C1(C)CC1F
InChIInChI=1S/C8H16FN3/c1-3-4-11-7(12-10)8(2)5-6(8)9/h6H,3-5,10H2,1-2H3,(H,11,12)
InChIKeyUQOFDYNIGVBLJL-UHFFFAOYSA-N
MW173.23 g/mol
LogP1.01
Rot. Bonds3

About N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide

N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide (PubChem CID 130900508) has the molecular formula C8H16FN3 and a molecular weight of 173.23 g/mol. Its IUPAC name is N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide.

Molecular Properties

Compound NameN-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide
PubChem CID130900508
Molecular FormulaC8H16FN3
Molecular Weight173.23 g/mol
Exact Mass173.13
IUPAC NameN-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide
SMILESCCC/N=C(\NN)C1(C)CC1F
InChIInChI=1S/C8H16FN3/c1-3-4-11-7(12-10)8(2)5-6(8)9/h6H,3-5,10H2,1-2H3,(H,11,12)
InChIKeyUQOFDYNIGVBLJL-UHFFFAOYSA-N
XLogP1.01
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.23
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide 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 N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide?
The IUPAC name of N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide (CID 130900508) is N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide.
What is the SMILES notation for N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide?
The canonical SMILES for N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide is CCC/N=C(\NN)C1(C)CC1F.
What is the InChIKey of N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide?
The InChIKey is UQOFDYNIGVBLJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FN3/c1-3-4-11-7(12-10)8(2)5-6(8)9/h6H,3-5,10H2,1-2H3,(H,11,12).
What are the key properties of N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide?
N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide has a molecular weight of 173.23 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-2-fluoro-1-methyl-N'-propylcyclopropane-1-carboximidamide is sourced from PubChem (CID 130900508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).