6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine

C15H22N2 — CID 59203708

IUPAC6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine
SMILESC[C@@H](c1ccccc1)N1CC(N)C2(CCC2)C1
InChIInChI=1S/C15H22N2/c1-12(13-6-3-2-4-7-13)17-10-14(16)15(11-17)8-5-9-15/h2-4,6-7,12,14H,5,8-11,16H2,1H3/t12-,14?/m0/s1
InChIKeyRUZDOUCRGPTJBM-NBFOIZRFSA-N
MW230.36 g/mol
LogP2.56
Rot. Bonds2

About 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine

6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine (PubChem CID 59203708) has the molecular formula C15H22N2 and a molecular weight of 230.36 g/mol. Its IUPAC name is 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine.

Molecular Properties

Compound Name6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine
PubChem CID59203708
Molecular FormulaC15H22N2
Molecular Weight230.36 g/mol
Exact Mass230.18
IUPAC Name6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine
SMILESC[C@@H](c1ccccc1)N1CC(N)C2(CCC2)C1
InChIInChI=1S/C15H22N2/c1-12(13-6-3-2-4-7-13)17-10-14(16)15(11-17)8-5-9-15/h2-4,6-7,12,14H,5,8-11,16H2,1H3/t12-,14?/m0/s1
InChIKeyRUZDOUCRGPTJBM-NBFOIZRFSA-N
XLogP2.56
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.36
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine?
The IUPAC name of 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine (CID 59203708) is 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine.
What is the SMILES notation for 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine?
The canonical SMILES for 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine is C[C@@H](c1ccccc1)N1CC(N)C2(CCC2)C1.
What is the InChIKey of 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine?
The InChIKey is RUZDOUCRGPTJBM-NBFOIZRFSA-N. The full InChI is InChI=1S/C15H22N2/c1-12(13-6-3-2-4-7-13)17-10-14(16)15(11-17)8-5-9-15/h2-4,6-7,12,14H,5,8-11,16H2,1H3/t12-,14?/m0/s1.
What are the key properties of 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine?
6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine has a molecular weight of 230.36 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1S)-1-phenylethyl]-6-azaspiro[3.4]octan-8-amine is sourced from PubChem (CID 59203708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).