(1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol

C15H27NO2 — CID 86283742

IUPAC(1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol
SMILESO[C@@H]1C[C@H](O)C12CCN(C1CCCCCC1)CC2
InChIInChI=1S/C15H27NO2/c17-13-11-14(18)15(13)7-9-16(10-8-15)12-5-3-1-2-4-6-12/h12-14,17-18H,1-11H2/t13-,14+
InChIKeyYYEMLYNJFWXICQ-OKILXGFUSA-N
MW253.39 g/mol
LogP1.92
Rot. Bonds1

About (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol

(1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol (PubChem CID 86283742) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol.

Molecular Properties

Compound Name(1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol
PubChem CID86283742
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name(1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol
SMILESO[C@@H]1C[C@H](O)C12CCN(C1CCCCCC1)CC2
InChIInChI=1S/C15H27NO2/c17-13-11-14(18)15(13)7-9-16(10-8-15)12-5-3-1-2-4-6-12/h12-14,17-18H,1-11H2/t13-,14+
InChIKeyYYEMLYNJFWXICQ-OKILXGFUSA-N
XLogP1.92
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol 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-cyclohexylazocane
CID 23151203
1-cyclooctylpyrrolidine
CID 23277874
1-cyclooctylpiperidine
CID 89210756
1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid
CID 115055583
1-cyclopentyl-4-methylazepan-4-ol
CID 107408390
1-cyclohexylpiperidine;methane
CID 143122486
1-cyclobutyl-4,4-dimethylpiperidine
CID 70344031
(1-cyclopentyl-4-methylpiperidin-4-yl)methanol
CID 83915889
1-cycloheptyl-4-(difluoromethyl)piperidin-4-amine
CID 115045866
1-cyclobutyl-4,4-difluoropiperidine
CID 91599149
1-cyclohexyl-3,3-difluoropyrrolidine
CID 117007575
5-(4-cyclopentylpiperazin-1-yl)-2,2-dimethylcyclopentan-1-ol
CID 79856703

Frequently Asked Questions

What is the IUPAC name of (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol?
The IUPAC name of (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol (CID 86283742) is (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol.
What is the SMILES notation for (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol?
The canonical SMILES for (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol is O[C@@H]1C[C@H](O)C12CCN(C1CCCCCC1)CC2.
What is the InChIKey of (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol?
The InChIKey is YYEMLYNJFWXICQ-OKILXGFUSA-N. The full InChI is InChI=1S/C15H27NO2/c17-13-11-14(18)15(13)7-9-16(10-8-15)12-5-3-1-2-4-6-12/h12-14,17-18H,1-11H2/t13-,14+.
What are the key properties of (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol?
(1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol has a molecular weight of 253.39 g/mol, XLogP of 1.92, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3S)-7-cycloheptyl-7-azaspiro[3.5]nonane-1,3-diol is sourced from PubChem (CID 86283742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).