8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane

C28H54N4 — CID 155277857

IUPAC8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane
SMILESCC(C)N1CCC2(CC1)CCN(C(C)CCC(C)N1CCC3(CCN(C(C)C)CC3)C1)C2
InChIInChI=1S/C28H54N4/c1-23(2)29-15-9-27(10-16-29)13-19-31(21-27)25(5)7-8-26(6)32-20-14-28(22-32)11-17-30(18-12-28)24(3)4/h23-26H,7-22H2,1-6H3
InChIKeyFKYNYDDACJLQPH-UHFFFAOYSA-N
MW446.77 g/mol
LogP4.94
Rot. Bonds7

About 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane

8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane (PubChem CID 155277857) has the molecular formula C28H54N4 and a molecular weight of 446.77 g/mol. Its IUPAC name is 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane
PubChem CID155277857
Molecular FormulaC28H54N4
Molecular Weight446.77 g/mol
Exact Mass446.43
IUPAC Name8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane
SMILESCC(C)N1CCC2(CC1)CCN(C(C)CCC(C)N1CCC3(CCN(C(C)C)CC3)C1)C2
InChIInChI=1S/C28H54N4/c1-23(2)29-15-9-27(10-16-29)13-19-31(21-27)25(5)7-8-26(6)32-20-14-28(22-32)11-17-30(18-12-28)24(3)4/h23-26H,7-22H2,1-6H3
InChIKeyFKYNYDDACJLQPH-UHFFFAOYSA-N
XLogP4.94
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.77
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane?
The IUPAC name of 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane (CID 155277857) is 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane is CC(C)N1CCC2(CC1)CCN(C(C)CCC(C)N1CCC3(CCN(C(C)C)CC3)C1)C2.
What is the InChIKey of 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane?
The InChIKey is FKYNYDDACJLQPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H54N4/c1-23(2)29-15-9-27(10-16-29)13-19-31(21-27)25(5)7-8-26(6)32-20-14-28(22-32)11-17-30(18-12-28)24(3)4/h23-26H,7-22H2,1-6H3.
What are the key properties of 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane?
8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane has a molecular weight of 446.77 g/mol, XLogP of 4.94, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-yl-2-[5-(8-propan-2-yl-2,8-diazaspiro[4.5]decan-2-yl)hexan-2-yl]-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 155277857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).