5-methylidene-3,3-diphenylpyrazolidine

C16H16N2 — CID 70583014

IUPAC5-methylidene-3,3-diphenylpyrazolidine
SMILESC=C1CC(c2ccccc2)(c2ccccc2)NN1
InChIInChI=1S/C16H16N2/c1-13-12-16(18-17-13,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,17-18H,1,12H2
InChIKeyRFHIJLVGWBBNEG-UHFFFAOYSA-N
MW236.32 g/mol
LogP2.94
Rot. Bonds2

About 5-methylidene-3,3-diphenylpyrazolidine

5-methylidene-3,3-diphenylpyrazolidine (PubChem CID 70583014) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is 5-methylidene-3,3-diphenylpyrazolidine.

Molecular Properties

Compound Name5-methylidene-3,3-diphenylpyrazolidine
PubChem CID70583014
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC Name5-methylidene-3,3-diphenylpyrazolidine
SMILESC=C1CC(c2ccccc2)(c2ccccc2)NN1
InChIInChI=1S/C16H16N2/c1-13-12-16(18-17-13,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,17-18H,1,12H2
InChIKeyRFHIJLVGWBBNEG-UHFFFAOYSA-N
XLogP2.94
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methylidene-3,3-diphenylpyrazolidine?
The IUPAC name of 5-methylidene-3,3-diphenylpyrazolidine (CID 70583014) is 5-methylidene-3,3-diphenylpyrazolidine.
What is the SMILES notation for 5-methylidene-3,3-diphenylpyrazolidine?
The canonical SMILES for 5-methylidene-3,3-diphenylpyrazolidine is C=C1CC(c2ccccc2)(c2ccccc2)NN1.
What is the InChIKey of 5-methylidene-3,3-diphenylpyrazolidine?
The InChIKey is RFHIJLVGWBBNEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2/c1-13-12-16(18-17-13,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,17-18H,1,12H2.
What are the key properties of 5-methylidene-3,3-diphenylpyrazolidine?
5-methylidene-3,3-diphenylpyrazolidine has a molecular weight of 236.32 g/mol, XLogP of 2.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidene-3,3-diphenylpyrazolidine is sourced from PubChem (CID 70583014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).