3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol

C18H35NO — CID 15634156

IUPAC3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol
SMILESCCCC1(CCC)CCC2(CCN(CCCO)C2)CC1
InChIInChI=1S/C18H35NO/c1-3-6-17(7-4-2)8-10-18(11-9-17)12-14-19(16-18)13-5-15-20/h20H,3-16H2,1-2H3
InChIKeyQVWILIXLXFMPGL-UHFFFAOYSA-N
MW281.48 g/mol
LogP4.22
Rot. Bonds7

About 3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol

3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol (PubChem CID 15634156) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is 3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol
PubChem CID15634156
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol
SMILESCCCC1(CCC)CCC2(CCN(CCCO)C2)CC1
InChIInChI=1S/C18H35NO/c1-3-6-17(7-4-2)8-10-18(11-9-17)12-14-19(16-18)13-5-15-20/h20H,3-16H2,1-2H3
InChIKeyQVWILIXLXFMPGL-UHFFFAOYSA-N
XLogP4.22
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.48
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol?
The IUPAC name of 3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol (CID 15634156) is 3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol.
What is the SMILES notation for 3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol?
The canonical SMILES for 3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol is CCCC1(CCC)CCC2(CCN(CCCO)C2)CC1.
What is the InChIKey of 3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol?
The InChIKey is QVWILIXLXFMPGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-3-6-17(7-4-2)8-10-18(11-9-17)12-14-19(16-18)13-5-15-20/h20H,3-16H2,1-2H3.
What are the key properties of 3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol?
3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol has a molecular weight of 281.48 g/mol, XLogP of 4.22, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)propan-1-ol is sourced from PubChem (CID 15634156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).