2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine

C15H25N3 — CID 142253116

IUPAC2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine
SMILESCN.c1ccc(CN2CCC3(CCNC3)C2)cc1
InChIInChI=1S/C14H20N2.CH5N/c1-2-4-13(5-3-1)10-16-9-7-14(12-16)6-8-15-11-14;1-2/h1-5,15H,6-12H2;2H2,1H3
InChIKeyAGRAAUZNVNYUOX-UHFFFAOYSA-N
MW247.39 g/mol
LogP1.45
Rot. Bonds2

About 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine

2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine (PubChem CID 142253116) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine.

Molecular Properties

Compound Name2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine
PubChem CID142253116
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine
SMILESCN.c1ccc(CN2CCC3(CCNC3)C2)cc1
InChIInChI=1S/C14H20N2.CH5N/c1-2-4-13(5-3-1)10-16-9-7-14(12-16)6-8-15-11-14;1-2/h1-5,15H,6-12H2;2H2,1H3
InChIKeyAGRAAUZNVNYUOX-UHFFFAOYSA-N
XLogP1.45
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine 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

(5R)-2-benzyl-2,7-diazaspiro[4.4]nonane
CID 34178522
2-[(3-fluorophenyl)methyl]-2,7-diazaspiro[4.4]nonane
CID 82038611
8-benzyl-3,8-diazaspiro[5.6]dodecane
CID 82665591
2-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120908278
7-benzyl-2,7-diazaspiro[3.5]nonane;ethane
CID 145233671
7-benzyl-2,7-diazaspiro[3.5]nonane;dihydrochloride
CID 67386428
2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2,7-diazaspiro[4.4]nonane
CID 120908289
2-(thiophen-3-ylmethyl)-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120907713
2-[(1-methylpyrazol-4-yl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120907742
2-benzyl-7-methyl-2,7-diazaspiro[4.4]nonane
CID 2868838
2-[(1-ethylpyrazol-4-yl)methyl]-2,7-diazaspiro[4.4]nonane
CID 120907844
2-[(3-fluoro-4-methylphenyl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120908775

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine?
The IUPAC name of 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine (CID 142253116) is 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine.
What is the SMILES notation for 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine?
The canonical SMILES for 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine is CN.c1ccc(CN2CCC3(CCNC3)C2)cc1.
What is the InChIKey of 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine?
The InChIKey is AGRAAUZNVNYUOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2.CH5N/c1-2-4-13(5-3-1)10-16-9-7-14(12-16)6-8-15-11-14;1-2/h1-5,15H,6-12H2;2H2,1H3.
What are the key properties of 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine?
2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine has a molecular weight of 247.39 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine is sourced from PubChem (CID 142253116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).