N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine

C6H12FN3 — CID 89432533

IUPACN-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine
SMILESCN1CCN=C1NCCF
InChIInChI=1S/C6H12FN3/c1-10-5-4-9-6(10)8-3-2-7/h2-5H2,1H3,(H,8,9)
InChIKeyPUZKLQVCRMCKFA-UHFFFAOYSA-N
MW145.18 g/mol
LogP-0.15
Rot. Bonds2

About N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine

N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine (PubChem CID 89432533) has the molecular formula C6H12FN3 and a molecular weight of 145.18 g/mol. Its IUPAC name is N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine
PubChem CID89432533
Molecular FormulaC6H12FN3
Molecular Weight145.18 g/mol
Exact Mass145.10
IUPAC NameN-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine
SMILESCN1CCN=C1NCCF
InChIInChI=1S/C6H12FN3/c1-10-5-4-9-6(10)8-3-2-7/h2-5H2,1H3,(H,8,9)
InChIKeyPUZKLQVCRMCKFA-UHFFFAOYSA-N
XLogP-0.15
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.18
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine 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-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine (CID 89432533) is N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine is CN1CCN=C1NCCF.
What is the InChIKey of N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine?
The InChIKey is PUZKLQVCRMCKFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FN3/c1-10-5-4-9-6(10)8-3-2-7/h2-5H2,1H3,(H,8,9).
What are the key properties of N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine?
N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine has a molecular weight of 145.18 g/mol, XLogP of -0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-1-methyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 89432533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).