trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium

C15H13N2+ — CID 10106251

IUPACtrans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium
SMILESN#[N+]C1[C@@H](c2ccccc2)[C@@H]1c1ccccc1
InChIInChI=1S/C15H13N2/c16-17-15-13(11-7-3-1-4-8-11)14(15)12-9-5-2-6-10-12/h1-10,13-15H/q+1/t13-,14-/m0/s1
InChIKeyFOORJSOTCXZPEH-KBPBESRZSA-N
MW221.28 g/mol
LogP3.79
Rot. Bonds2

About trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium

trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium (PubChem CID 10106251) has the molecular formula C15H13N2+ and a molecular weight of 221.28 g/mol. Its IUPAC name is trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium.

Molecular Properties

Compound Nametrans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium
PubChem CID10106251
Molecular FormulaC15H13N2+
Molecular Weight221.28 g/mol
Exact Mass221.11
IUPAC Nametrans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium
SMILESN#[N+]C1[C@@H](c2ccccc2)[C@@H]1c1ccccc1
InChIInChI=1S/C15H13N2/c16-17-15-13(11-7-3-1-4-8-11)14(15)12-9-5-2-6-10-12/h1-10,13-15H/q+1/t13-,14-/m0/s1
InChIKeyFOORJSOTCXZPEH-KBPBESRZSA-N
XLogP3.79
TPSA28.15 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium?
The IUPAC name of trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium (CID 10106251) is trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium.
What is the SMILES notation for trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium?
The canonical SMILES for trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium is N#[N+]C1[C@@H](c2ccccc2)[C@@H]1c1ccccc1.
What is the InChIKey of trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium?
The InChIKey is FOORJSOTCXZPEH-KBPBESRZSA-N. The full InChI is InChI=1S/C15H13N2/c16-17-15-13(11-7-3-1-4-8-11)14(15)12-9-5-2-6-10-12/h1-10,13-15H/q+1/t13-,14-/m0/s1.
What are the key properties of trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium?
trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium has a molecular weight of 221.28 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(2R,3R)-2,3-diphenylcyclopropane-1-diazonium is sourced from PubChem (CID 10106251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).