8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane

C24H46N4 — CID 134228092

IUPAC8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane
SMILESCC(C)(CCC(C)(C)N1CCC2(CCCN2)CC1)N1CCC2(CCNC2)CC1
InChIInChI=1S/C24H46N4/c1-21(2,27-16-10-23(11-17-27)9-15-25-20-23)7-8-22(3,4)28-18-12-24(13-19-28)6-5-14-26-24/h25-26H,5-20H2,1-4H3
InChIKeyHAAYPHHEPYAAMH-UHFFFAOYSA-N
MW390.66 g/mol
LogP3.62
Rot. Bonds5

About 8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane

8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane (PubChem CID 134228092) has the molecular formula C24H46N4 and a molecular weight of 390.66 g/mol. Its IUPAC name is 8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane
PubChem CID134228092
Molecular FormulaC24H46N4
Molecular Weight390.66 g/mol
Exact Mass390.37
IUPAC Name8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane
SMILESCC(C)(CCC(C)(C)N1CCC2(CCCN2)CC1)N1CCC2(CCNC2)CC1
InChIInChI=1S/C24H46N4/c1-21(2,27-16-10-23(11-17-27)9-15-25-20-23)7-8-22(3,4)28-18-12-24(13-19-28)6-5-14-26-24/h25-26H,5-20H2,1-4H3
InChIKeyHAAYPHHEPYAAMH-UHFFFAOYSA-N
XLogP3.62
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.66
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane?
The IUPAC name of 8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane (CID 134228092) is 8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane is CC(C)(CCC(C)(C)N1CCC2(CCCN2)CC1)N1CCC2(CCNC2)CC1.
What is the InChIKey of 8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane?
The InChIKey is HAAYPHHEPYAAMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46N4/c1-21(2,27-16-10-23(11-17-27)9-15-25-20-23)7-8-22(3,4)28-18-12-24(13-19-28)6-5-14-26-24/h25-26H,5-20H2,1-4H3.
What are the key properties of 8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane?
8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane has a molecular weight of 390.66 g/mol, XLogP of 3.62, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[5-(1,8-diazaspiro[4.5]decan-8-yl)-2,5-dimethylhexan-2-yl]-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 134228092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).