8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol

C15H25NO3 — CID 63768913

IUPAC8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol
SMILESOC1CC2CCC(C1)N2CC1COC2(CCCC2)O1
InChIInChI=1S/C15H25NO3/c17-13-7-11-3-4-12(8-13)16(11)9-14-10-18-15(19-14)5-1-2-6-15/h11-14,17H,1-10H2
InChIKeySJNUEZSWTWXVQK-UHFFFAOYSA-N
MW267.37 g/mol
LogP1.66
Rot. Bonds2

About 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol

8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol (PubChem CID 63768913) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol.

Molecular Properties

Compound Name8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol
PubChem CID63768913
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol
SMILESOC1CC2CCC(C1)N2CC1COC2(CCCC2)O1
InChIInChI=1S/C15H25NO3/c17-13-7-11-3-4-12(8-13)16(11)9-14-10-18-15(19-14)5-1-2-6-15/h11-14,17H,1-10H2
InChIKeySJNUEZSWTWXVQK-UHFFFAOYSA-N
XLogP1.66
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1,4-dioxaspiro[4.11]hexadecan-3-ylmethyl)piperidine
CID 2832845
[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]methanol
CID 62019901
3-ethyl-1,4-dioxaspiro[4.4]nonane
CID 20802298
[4-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)morpholin-2-yl]methanol
CID 81218739
(3S)-3-ethyl-1,4-dioxaspiro[4.5]decane
CID 129156956
8-(cyclopentylmethyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 63770465
2-[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-2-yl]ethanol
CID 62021772
[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-4-methylpiperidin-3-yl]methanamine
CID 114961047
1-[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)azetidin-3-yl]piperazine
CID 66195421
3-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-3,9-diazabicyclo[4.2.1]nonane
CID 115314326
1-[1-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)piperidin-4-yl]-N-methylmethanamine
CID 55176251
3-propyl-1,4-dioxaspiro[4.4]nonane
CID 14592507

Frequently Asked Questions

What is the IUPAC name of 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol?
The IUPAC name of 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol (CID 63768913) is 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol.
What is the SMILES notation for 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol?
The canonical SMILES for 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol is OC1CC2CCC(C1)N2CC1COC2(CCCC2)O1.
What is the InChIKey of 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol?
The InChIKey is SJNUEZSWTWXVQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c17-13-7-11-3-4-12(8-13)16(11)9-14-10-18-15(19-14)5-1-2-6-15/h11-14,17H,1-10H2.
What are the key properties of 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol?
8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol has a molecular weight of 267.37 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1,4-dioxaspiro[4.4]nonan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ol is sourced from PubChem (CID 63768913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).