(8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol

C16H23NO2 — CID 22744409

IUPAC(8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol
SMILESOCC1CCC2(CCN(Cc3ccccc3)CC2)O1
InChIInChI=1S/C16H23NO2/c18-13-15-6-7-16(19-15)8-10-17(11-9-16)12-14-4-2-1-3-5-14/h1-5,15,18H,6-13H2
InChIKeyFEIPBEMSUMTAJW-UHFFFAOYSA-N
MW261.36 g/mol
LogP2.19
Rot. Bonds3

About (8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol

(8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol (PubChem CID 22744409) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is (8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol.

Molecular Properties

Compound Name(8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol
PubChem CID22744409
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name(8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol
SMILESOCC1CCC2(CCN(Cc3ccccc3)CC2)O1
InChIInChI=1S/C16H23NO2/c18-13-15-6-7-16(19-15)8-10-17(11-9-16)12-14-4-2-1-3-5-14/h1-5,15,18H,6-13H2
InChIKeyFEIPBEMSUMTAJW-UHFFFAOYSA-N
XLogP2.19
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(2R)-8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]-2-pyrimidin-2-ylsulfanylacetamide
CID 42273015
2-phenyl-N-[[8-(pyridin-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]acetamide
CID 45170967
(2S)-N-[[(2R)-8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]-2-methoxy-2-phenylacetamide
CID 42343316
[8-(pyridin-4-ylmethyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methanamine
CID 118760264
4-phenyl-N-[[8-(pyridin-4-ylmethyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]butanamide
CID 45242799
N-[(8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]-2-(2,4-dioxo-1,3-thiazolidin-5-ylidene)acetamide
CID 74501803
N-[[(2S)-8-[(3-phenoxyphenyl)methyl]-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]acetamide
CID 42341477
N-[(8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methyl]-2-(7-methyl-2-oxochromen-4-yl)acetamide
CID 45172256
N-[[(2S)-8-(2-phenylethyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]benzamide
CID 42440769
(11-benzyl-1,4,8-trioxa-11-azadispiro[4.1.57.35]pentadecan-9-yl)methanol
CID 139384919
N-[[8-[[4-(2-methylpropyl)phenyl]methyl]-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]furan-2-carboxamide
CID 45186392
1-benzyl-4-methylpiperidin-4-ol
CID 10845913

Frequently Asked Questions

What is the IUPAC name of (8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol?
The IUPAC name of (8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol (CID 22744409) is (8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol.
What is the SMILES notation for (8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol?
The canonical SMILES for (8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol is OCC1CCC2(CCN(Cc3ccccc3)CC2)O1.
What is the InChIKey of (8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol?
The InChIKey is FEIPBEMSUMTAJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c18-13-15-6-7-16(19-15)8-10-17(11-9-16)12-14-4-2-1-3-5-14/h1-5,15,18H,6-13H2.
What are the key properties of (8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol?
(8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol has a molecular weight of 261.36 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-benzyl-1-oxa-8-azaspiro[4.5]decan-2-yl)methanol is sourced from PubChem (CID 22744409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).