9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone

C22H34N2O6 — CID 102387473

IUPAC9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone
SMILESCC1(C)COC(=O)C2(CCCC2)NC(=O)C(C)(C)COC(=O)C2(CCCC2)NC1=O
InChIInChI=1S/C22H34N2O6/c1-19(2)13-29-17(27)22(11-7-8-12-22)24-16(26)20(3,4)14-30-18(28)21(23-15(19)25)9-5-6-10-21/h5-14H2,1-4H3,(H,23,25)(H,24,26)
InChIKeyRAUOLAULVCOQSC-UHFFFAOYSA-N
MW422.52 g/mol
LogP2.00
Rot. Bonds

About 9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone

9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone (PubChem CID 102387473) has the molecular formula C22H34N2O6 and a molecular weight of 422.52 g/mol. Its IUPAC name is 9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone.

Molecular Properties

Compound Name9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone
PubChem CID102387473
Molecular FormulaC22H34N2O6
Molecular Weight422.52 g/mol
Exact Mass422.24
IUPAC Name9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone
SMILESCC1(C)COC(=O)C2(CCCC2)NC(=O)C(C)(C)COC(=O)C2(CCCC2)NC1=O
InChIInChI=1S/C22H34N2O6/c1-19(2)13-29-17(27)22(11-7-8-12-22)24-16(26)20(3,4)14-30-18(28)21(23-15(19)25)9-5-6-10-21/h5-14H2,1-4H3,(H,23,25)(H,24,26)
InChIKeyRAUOLAULVCOQSC-UHFFFAOYSA-N
XLogP2.00
TPSA110.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.52
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone?
The IUPAC name of 9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone (CID 102387473) is 9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone.
What is the SMILES notation for 9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone?
The canonical SMILES for 9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone is CC1(C)COC(=O)C2(CCCC2)NC(=O)C(C)(C)COC(=O)C2(CCCC2)NC1=O.
What is the InChIKey of 9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone?
The InChIKey is RAUOLAULVCOQSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2O6/c1-19(2)13-29-17(27)22(11-7-8-12-22)24-16(26)20(3,4)14-30-18(28)21(23-15(19)25)9-5-6-10-21/h5-14H2,1-4H3,(H,23,25)(H,24,26).
What are the key properties of 9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone?
9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone has a molecular weight of 422.52 g/mol, XLogP of 2.00, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9,20,20-tetramethyl-7,18-dioxa-11,22-diazadispiro[4.6.412.65]docosane-6,10,17,21-tetrone is sourced from PubChem (CID 102387473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).