6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane

C18H34N2O — CID 65170179

IUPAC6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane
SMILESCC(C)C1CN(CCCC2CCCO2)C2(CCCC2)CN1
InChIInChI=1S/C18H34N2O/c1-15(2)17-13-20(11-5-7-16-8-6-12-21-16)18(14-19-17)9-3-4-10-18/h15-17,19H,3-14H2,1-2H3
InChIKeyQCUKBHQUVJXIBY-UHFFFAOYSA-N
MW294.48 g/mol
LogP3.19
Rot. Bonds5

About 6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane

6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane (PubChem CID 65170179) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane
PubChem CID65170179
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane
SMILESCC(C)C1CN(CCCC2CCCO2)C2(CCCC2)CN1
InChIInChI=1S/C18H34N2O/c1-15(2)17-13-20(11-5-7-16-8-6-12-21-16)18(14-19-17)9-3-4-10-18/h15-17,19H,3-14H2,1-2H3
InChIKeyQCUKBHQUVJXIBY-UHFFFAOYSA-N
XLogP3.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane (CID 65170179) is 6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane is CC(C)C1CN(CCCC2CCCO2)C2(CCCC2)CN1.
What is the InChIKey of 6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane?
The InChIKey is QCUKBHQUVJXIBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-15(2)17-13-20(11-5-7-16-8-6-12-21-16)18(14-19-17)9-3-4-10-18/h15-17,19H,3-14H2,1-2H3.
What are the key properties of 6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane?
6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane has a molecular weight of 294.48 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 65170179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).