1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide

C5H10F3IN4 — CID 131714398

IUPAC1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide
SMILESFC(F)(F)CNNC1=NCCN1.I
InChIInChI=1S/C5H9F3N4.HI/c6-5(7,8)3-11-12-4-9-1-2-10-4;/h11H,1-3H2,(H2,9,10,12);1H
InChIKeyQDDQGPJLDWTIGB-UHFFFAOYSA-N
MW310.06 g/mol
LogP0.22
Rot. Bonds2

About 1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide

1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide (PubChem CID 131714398) has the molecular formula C5H10F3IN4 and a molecular weight of 310.06 g/mol. Its IUPAC name is 1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide.

Molecular Properties

Compound Name1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide
PubChem CID131714398
Molecular FormulaC5H10F3IN4
Molecular Weight310.06 g/mol
Exact Mass309.99
IUPAC Name1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide
SMILESFC(F)(F)CNNC1=NCCN1.I
InChIInChI=1S/C5H9F3N4.HI/c6-5(7,8)3-11-12-4-9-1-2-10-4;/h11H,1-3H2,(H2,9,10,12);1H
InChIKeyQDDQGPJLDWTIGB-UHFFFAOYSA-N
XLogP0.22
TPSA48.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.06
LogP ≤ 50.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-hydrazinyl-4,5-dihydro-1H-imidazole hydroiodide
CID 12221230
1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine
CID 20261900
2-hydrazino-4,5-dihydro-1H-imidazol-1-ium iodide
CID 172677877
1-Amino-3-(2,2-difluoroethyl)-2-methylguanidine
CID 104882385
1-Amino-3-ethyl-2-(3,3,3-trifluoropropyl)guanidine
CID 104885802
1-Amino-2-(2,2-difluoroethyl)-3-ethylguanidine
CID 104887786
1-Amino-2-methyl-3-(2,2,2-trifluoroethyl)guanidine
CID 121599476
1-Amino-3-ethyl-2-(2,2,2-trifluoroethyl)guanidine
CID 121599509
N-[amino-[amino-[2-(methylamino)ethyl]amino]methylidene]-2,2,2-trifluoro-N'-methylethanimidamide
CID 147867792
1-(4,5-dihydro-1H-imidazol-2-yl)-2-methylhydrazine
CID 20261906
(4,5-dihydro-1H-imidazol-2-ylamino)-methanidylazanium
CID 59074010
(2-hydrazinyl-4,5-dihydro-1H-imidazol-5-yl)hydrazine
CID 70409192

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide?
The IUPAC name of 1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide (CID 131714398) is 1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide.
What is the SMILES notation for 1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide?
The canonical SMILES for 1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide is FC(F)(F)CNNC1=NCCN1.I.
What is the InChIKey of 1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide?
The InChIKey is QDDQGPJLDWTIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F3N4.HI/c6-5(7,8)3-11-12-4-9-1-2-10-4;/h11H,1-3H2,(H2,9,10,12);1H.
What are the key properties of 1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide?
1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide has a molecular weight of 310.06 g/mol, XLogP of 0.22, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dihydro-1H-imidazol-2-yl)-2-(2,2,2-trifluoroethyl)hydrazine;hydroiodide is sourced from PubChem (CID 131714398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).