2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol

C16H24N2O — CID 83488694

IUPAC2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol
SMILESOC1CCCNCC12CCN(Cc1ccccc1)C2
InChIInChI=1S/C16H24N2O/c19-15-7-4-9-17-12-16(15)8-10-18(13-16)11-14-5-2-1-3-6-14/h1-3,5-6,15,17,19H,4,7-13H2
InChIKeySPFXGQSNEKCXJA-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.62
Rot. Bonds2

About 2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol

2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol (PubChem CID 83488694) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol.

Molecular Properties

Compound Name2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol
PubChem CID83488694
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol
SMILESOC1CCCNCC12CCN(Cc1ccccc1)C2
InChIInChI=1S/C16H24N2O/c19-15-7-4-9-17-12-16(15)8-10-18(13-16)11-14-5-2-1-3-6-14/h1-3,5-6,15,17,19H,4,7-13H2
InChIKeySPFXGQSNEKCXJA-UHFFFAOYSA-N
XLogP1.62
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

7-benzyl-7-azaspiro[4.5]decan-10-ol
CID 82384805
6-benzyl-6-azaspiro[2.5]octan-8-ol
CID 66783213
(5R)-2-benzyl-2,7-diazaspiro[4.4]nonane
CID 34178522
7-benzyl-7-azaspiro[4.5]decan-10-amine
CID 82385401
5-benzyl-5-azaspiro[2.4]heptan-7-ol
CID 58452923
2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane
CID 79320158
(5R,6R)-6-fluoro-2-(pyridin-4-ylmethyl)-2,9-diazaspiro[4.5]decane
CID 98778577
(6S,11S)-2-[[3-[3-(trifluoromethyl)phenoxy]phenyl]methyl]-2,8-diazaspiro[5.5]undecan-11-ol
CID 164690797
(4R,5S)-7-[(4-chlorophenyl)methyl]-7-azaspiro[4.5]decan-4-ol
CID 135097855
2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine
CID 142253116
2-benzyl-6-propyl-2,8-diazaspiro[4.5]decane
CID 79321591
2-benzyl-6-(4-methylphenyl)-2,8-diazaspiro[4.5]decane
CID 113247774

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol?
The IUPAC name of 2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol (CID 83488694) is 2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol.
What is the SMILES notation for 2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol?
The canonical SMILES for 2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol is OC1CCCNCC12CCN(Cc1ccccc1)C2.
What is the InChIKey of 2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol?
The InChIKey is SPFXGQSNEKCXJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c19-15-7-4-9-17-12-16(15)8-10-18(13-16)11-14-5-2-1-3-6-14/h1-3,5-6,15,17,19H,4,7-13H2.
What are the key properties of 2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol?
2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol has a molecular weight of 260.38 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol is sourced from PubChem (CID 83488694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).