8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one

C62H109N7O11 — CID 20768154

IUPAC8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one
SMILESCC1(C)CC2(CC(C)(C)N1)OC(C)(C)N(CC(O)CC1C(C)(C)CC3(CC1(C)C)OC(C)(C)N(CC(O)CN1C(=O)C4(CC(C)(C)N(CC(O)CN5C(=O)C6(CC(C)(C)NC(C)(C)C6)OC5(C)C)C(C)(C)C4)OC1(C)C)C3=O)C2=O
InChIInChI=1S/C62H109N7O11/c1-47(2)31-59(32-48(3,4)42(47)25-39(70)26-65-44(74)60(78-55(65,17)18)33-49(5,6)63-50(7,8)34-60)43(73)66(56(19,20)77-59)27-40(71)28-67-46(76)62(80-58(67,23)24)37-53(13,14)69(54(15,16)38-62)30-41(72)29-68-45(75)61(79-57(68,21)22)35-51(9,10)64-52(11,12)36-61/h39-42,63-64,70-72H,25-38H2,1-24H3
InChIKeyQJGZGNOXQLJXPU-UHFFFAOYSA-N
MW1128.59 g/mol
LogP6.79
Rot. Bonds12

About 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one

8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one (PubChem CID 20768154) has the molecular formula C62H109N7O11 and a molecular weight of 1128.59 g/mol. Its IUPAC name is 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one.

Molecular Properties

Compound Name8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one
PubChem CID20768154
Molecular FormulaC62H109N7O11
Molecular Weight1128.59 g/mol
Exact Mass1127.82
IUPAC Name8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one
SMILESCC1(C)CC2(CC(C)(C)N1)OC(C)(C)N(CC(O)CC1C(C)(C)CC3(CC1(C)C)OC(C)(C)N(CC(O)CN1C(=O)C4(CC(C)(C)N(CC(O)CN5C(=O)C6(CC(C)(C)NC(C)(C)C6)OC5(C)C)C(C)(C)C4)OC1(C)C)C3=O)C2=O
InChIInChI=1S/C62H109N7O11/c1-47(2)31-59(32-48(3,4)42(47)25-39(70)26-65-44(74)60(78-55(65,17)18)33-49(5,6)63-50(7,8)34-60)43(73)66(56(19,20)77-59)27-40(71)28-67-46(76)62(80-58(67,23)24)37-53(13,14)69(54(15,16)38-62)30-41(72)29-68-45(75)61(79-57(68,21)22)35-51(9,10)64-52(11,12)36-61/h39-42,63-64,70-72H,25-38H2,1-24H3
InChIKeyQJGZGNOXQLJXPU-UHFFFAOYSA-N
XLogP6.79
TPSA206.15 Ų
H-Bond Donors5
H-Bond Acceptors14
Rotatable Bonds12
Heavy Atoms80
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001128.59
LogP ≤ 56.79
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1014

Analyze 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one?
The IUPAC name of 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one (CID 20768154) is 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one.
What is the SMILES notation for 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one?
The canonical SMILES for 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one is CC1(C)CC2(CC(C)(C)N1)OC(C)(C)N(CC(O)CC1C(C)(C)CC3(CC1(C)C)OC(C)(C)N(CC(O)CN1C(=O)C4(CC(C)(C)N(CC(O)CN5C(=O)C6(CC(C)(C)NC(C)(C)C6)OC5(C)C)C(C)(C)C4)OC1(C)C)C3=O)C2=O.
What is the InChIKey of 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one?
The InChIKey is QJGZGNOXQLJXPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H109N7O11/c1-47(2)31-59(32-48(3,4)42(47)25-39(70)26-65-44(74)60(78-55(65,17)18)33-49(5,6)63-50(7,8)34-60)43(73)66(56(19,20)77-59)27-40(71)28-67-46(76)62(80-58(67,23)24)37-53(13,14)69(54(15,16)38-62)30-41(72)29-68-45(75)61(79-57(68,21)22)35-51(9,10)64-52(11,12)36-61/h39-42,63-64,70-72H,25-38H2,1-24H3.
What are the key properties of 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one?
8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one has a molecular weight of 1128.59 g/mol, XLogP of 6.79, 12 rotatable bonds, 5 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-3-[3-[8-[3-(2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-4-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl]-2-hydroxypropyl]-2,2,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one is sourced from PubChem (CID 20768154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).