4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine]

C34H26ClN — CID 4171988

IUPAC4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine]
SMILESClc1ccc(C2C(c3ccccc3)NC(c3ccccc3)C23c2ccccc2-c2ccccc23)cc1
InChIInChI=1S/C34H26ClN/c35-26-21-19-23(20-22-26)31-32(24-11-3-1-4-12-24)36-33(25-13-5-2-6-14-25)34(31)29-17-9-7-15-27(29)28-16-8-10-18-30(28)34/h1-22,31-33,36H
InChIKeyRWHGNXSPUOHXDW-UHFFFAOYSA-N
MW484.04 g/mol
LogP8.48
Rot. Bonds3

About 4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine]

4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine] (PubChem CID 4171988) has the molecular formula C34H26ClN and a molecular weight of 484.04 g/mol. Its IUPAC name is 4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine].

Molecular Properties

Compound Name4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine]
PubChem CID4171988
Molecular FormulaC34H26ClN
Molecular Weight484.04 g/mol
Exact Mass483.18
IUPAC Name4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine]
SMILESClc1ccc(C2C(c3ccccc3)NC(c3ccccc3)C23c2ccccc2-c2ccccc23)cc1
InChIInChI=1S/C34H26ClN/c35-26-21-19-23(20-22-26)31-32(24-11-3-1-4-12-24)36-33(25-13-5-2-6-14-25)34(31)29-17-9-7-15-27(29)28-16-8-10-18-30(28)34/h1-22,31-33,36H
InChIKeyRWHGNXSPUOHXDW-UHFFFAOYSA-N
XLogP8.48
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.04
LogP ≤ 58.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine]?
The IUPAC name of 4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine] (CID 4171988) is 4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine].
What is the SMILES notation for 4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine]?
The canonical SMILES for 4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine] is Clc1ccc(C2C(c3ccccc3)NC(c3ccccc3)C23c2ccccc2-c2ccccc23)cc1.
What is the InChIKey of 4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine]?
The InChIKey is RWHGNXSPUOHXDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26ClN/c35-26-21-19-23(20-22-26)31-32(24-11-3-1-4-12-24)36-33(25-13-5-2-6-14-25)34(31)29-17-9-7-15-27(29)28-16-8-10-18-30(28)34/h1-22,31-33,36H.
What are the key properties of 4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine]?
4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine] has a molecular weight of 484.04 g/mol, XLogP of 8.48, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4'-(4-chlorophenyl)-2',5'-diphenylspiro[fluorene-9,3'-pyrrolidine] is sourced from PubChem (CID 4171988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).