1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one

C23H36N2O — CID 18684530

IUPAC1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one
SMILESCc1c(C)c(C)c2c(c1C)N(C)C(=O)C21N(C)C(C)(C)C(C)(C)C1(C)C
InChIInChI=1S/C23H36N2O/c1-13-14(2)16(4)18-17(15(13)3)23(19(26)24(18)11)21(7,8)20(5,6)22(9,10)25(23)12/h1-12H3
InChIKeyBYWDVPOYALAUJQ-UHFFFAOYSA-N
MW356.55 g/mol
LogP4.87
Rot. Bonds

About 1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one

1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one (PubChem CID 18684530) has the molecular formula C23H36N2O and a molecular weight of 356.55 g/mol. Its IUPAC name is 1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one.

Molecular Properties

Compound Name1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one
PubChem CID18684530
Molecular FormulaC23H36N2O
Molecular Weight356.55 g/mol
Exact Mass356.28
IUPAC Name1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one
SMILESCc1c(C)c(C)c2c(c1C)N(C)C(=O)C21N(C)C(C)(C)C(C)(C)C1(C)C
InChIInChI=1S/C23H36N2O/c1-13-14(2)16(4)18-17(15(13)3)23(19(26)24(18)11)21(7,8)20(5,6)22(9,10)25(23)12/h1-12H3
InChIKeyBYWDVPOYALAUJQ-UHFFFAOYSA-N
XLogP4.87
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.55
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one?
The IUPAC name of 1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one (CID 18684530) is 1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one.
What is the SMILES notation for 1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one?
The canonical SMILES for 1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one is Cc1c(C)c(C)c2c(c1C)N(C)C(=O)C21N(C)C(C)(C)C(C)(C)C1(C)C.
What is the InChIKey of 1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one?
The InChIKey is BYWDVPOYALAUJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H36N2O/c1-13-14(2)16(4)18-17(15(13)3)23(19(26)24(18)11)21(7,8)20(5,6)22(9,10)25(23)12/h1-12H3.
What are the key properties of 1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one?
1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one has a molecular weight of 356.55 g/mol, XLogP of 4.87, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1',3',3',4,4',4',5,5',5',6,7-dodecamethylspiro[indole-3,2'-pyrrolidine]-2-one is sourced from PubChem (CID 18684530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).