5-benzyl-5-azaspiro[2.4]heptan-7-ol

C13H17NO — CID 58452923

IUPAC5-benzyl-5-azaspiro[2.4]heptan-7-ol
SMILESOC1CN(Cc2ccccc2)CC12CC2
InChIInChI=1S/C13H17NO/c15-12-9-14(10-13(12)6-7-13)8-11-4-2-1-3-5-11/h1-5,12,15H,6-10H2
InChIKeyAFJLHUVJNCKMKW-UHFFFAOYSA-N
MW203.29 g/mol
LogP1.64
Rot. Bonds2

About 5-benzyl-5-azaspiro[2.4]heptan-7-ol

5-benzyl-5-azaspiro[2.4]heptan-7-ol (PubChem CID 58452923) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is 5-benzyl-5-azaspiro[2.4]heptan-7-ol.

Molecular Properties

Compound Name5-benzyl-5-azaspiro[2.4]heptan-7-ol
PubChem CID58452923
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC Name5-benzyl-5-azaspiro[2.4]heptan-7-ol
SMILESOC1CN(Cc2ccccc2)CC12CC2
InChIInChI=1S/C13H17NO/c15-12-9-14(10-13(12)6-7-13)8-11-4-2-1-3-5-11/h1-5,12,15H,6-10H2
InChIKeyAFJLHUVJNCKMKW-UHFFFAOYSA-N
XLogP1.64
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-benzyl-5-azaspiro[2.4]heptan-7-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

6-benzyl-6-azaspiro[2.5]octan-8-ol
CID 66783213
7-benzyl-7-azaspiro[4.5]decan-10-ol
CID 82384805
7-azido-5-benzyl-5-azaspiro[2.4]heptane
CID 139332390
N-[(7S)-5-benzyl-5-azaspiro[2.4]heptan-7-yl]acetamide
CID 139918944
8-benzyl-2-[bis(4-fluorophenyl)methyl]-2,8-diazaspiro[4.5]decan-6-ol
CID 118962915
[(4S)-2-benzyl-2,8-diazaspiro[4.5]decan-4-yl]methanol
CID 99728174
[(8R)-5-benzyl-8-methyl-5-azaspiro[2.5]octan-7-yl]carbamic acid
CID 20792051
(3R,4S)-1-benzyl-4-methylpiperidine-3,4-diol
CID 69059860
[(8R)-6-benzyl-6-azaspiro[3.4]octan-8-yl]methanamine
CID 125424290
2-benzyl-8-oxa-2-azaspiro[4.5]decan-4-amine
CID 83825243
1-benzylazepane-3,4,5,6-tetrol
CID 18417354
(3S,4R,5R,6S)-1-benzylazepane-3,4,5,6-tetrol
CID 10824756

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-5-azaspiro[2.4]heptan-7-ol?
The IUPAC name of 5-benzyl-5-azaspiro[2.4]heptan-7-ol (CID 58452923) is 5-benzyl-5-azaspiro[2.4]heptan-7-ol.
What is the SMILES notation for 5-benzyl-5-azaspiro[2.4]heptan-7-ol?
The canonical SMILES for 5-benzyl-5-azaspiro[2.4]heptan-7-ol is OC1CN(Cc2ccccc2)CC12CC2.
What is the InChIKey of 5-benzyl-5-azaspiro[2.4]heptan-7-ol?
The InChIKey is AFJLHUVJNCKMKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c15-12-9-14(10-13(12)6-7-13)8-11-4-2-1-3-5-11/h1-5,12,15H,6-10H2.
What are the key properties of 5-benzyl-5-azaspiro[2.4]heptan-7-ol?
5-benzyl-5-azaspiro[2.4]heptan-7-ol has a molecular weight of 203.29 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-5-azaspiro[2.4]heptan-7-ol is sourced from PubChem (CID 58452923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).