fluoro(propan-2-yl)diazene

C3H7FN2 — CID 140984474

IUPACfluoro(propan-2-yl)diazene
SMILESCC(C)/N=N/F
InChIInChI=1S/C3H7FN2/c1-3(2)5-6-4/h3H,1-2H3/b6-5+
InChIKeySDWXUQJEQNZSIN-AATRIKPKSA-N
MW90.10 g/mol
LogP1.73
Rot. Bonds1

About fluoro(propan-2-yl)diazene

fluoro(propan-2-yl)diazene (PubChem CID 140984474) has the molecular formula C3H7FN2 and a molecular weight of 90.10 g/mol. Its IUPAC name is fluoro(propan-2-yl)diazene.

Molecular Properties

Compound Namefluoro(propan-2-yl)diazene
PubChem CID140984474
Molecular FormulaC3H7FN2
Molecular Weight90.10 g/mol
Exact Mass90.06
IUPAC Namefluoro(propan-2-yl)diazene
SMILESCC(C)/N=N/F
InChIInChI=1S/C3H7FN2/c1-3(2)5-6-4/h3H,1-2H3/b6-5+
InChIKeySDWXUQJEQNZSIN-AATRIKPKSA-N
XLogP1.73
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50090.10
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of fluoro(propan-2-yl)diazene?
The IUPAC name of fluoro(propan-2-yl)diazene (CID 140984474) is fluoro(propan-2-yl)diazene.
What is the SMILES notation for fluoro(propan-2-yl)diazene?
The canonical SMILES for fluoro(propan-2-yl)diazene is CC(C)/N=N/F.
What is the InChIKey of fluoro(propan-2-yl)diazene?
The InChIKey is SDWXUQJEQNZSIN-AATRIKPKSA-N. The full InChI is InChI=1S/C3H7FN2/c1-3(2)5-6-4/h3H,1-2H3/b6-5+.
What are the key properties of fluoro(propan-2-yl)diazene?
fluoro(propan-2-yl)diazene has a molecular weight of 90.10 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro(propan-2-yl)diazene is sourced from PubChem (CID 140984474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).