6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane

C21H26N2 — CID 64877476

IUPAC6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane
SMILESc1ccc(CN2CC(c3ccccc3)NCC23CCCC3)cc1
InChIInChI=1S/C21H26N2/c1-3-9-18(10-4-1)15-23-16-20(19-11-5-2-6-12-19)22-17-21(23)13-7-8-14-21/h1-6,9-12,20,22H,7-8,13-17H2
InChIKeyZEDPCLBZEGLOCC-UHFFFAOYSA-N
MW306.45 g/mol
LogP4.15
Rot. Bonds3

About 6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane

6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane (PubChem CID 64877476) has the molecular formula C21H26N2 and a molecular weight of 306.45 g/mol. Its IUPAC name is 6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane
PubChem CID64877476
Molecular FormulaC21H26N2
Molecular Weight306.45 g/mol
Exact Mass306.21
IUPAC Name6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane
SMILESc1ccc(CN2CC(c3ccccc3)NCC23CCCC3)cc1
InChIInChI=1S/C21H26N2/c1-3-9-18(10-4-1)15-23-16-20(19-11-5-2-6-12-19)22-17-21(23)13-7-8-14-21/h1-6,9-12,20,22H,7-8,13-17H2
InChIKeyZEDPCLBZEGLOCC-UHFFFAOYSA-N
XLogP4.15
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.45
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-phenyl-6-prop-2-enyl-6,9-diazaspiro[4.5]decane
CID 64877089
6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane
CID 64848189
6-[(4-bromophenyl)methyl]-8-methyl-6,9-diazaspiro[4.5]decane
CID 64845332
7-benzyl-2,7-diazaspiro[5.6]dodecane
CID 82623667
6-[(4-iodophenyl)methyl]-8-propyl-6,9-diazaspiro[4.5]decane
CID 65490573
1-[(4-bromophenyl)methyl]-3-methyl-1,4-diazaspiro[5.5]undecane
CID 64845931
2,2-dimethyl-1-[(1-methylpyrazol-4-yl)methyl]-5-phenylpiperazine
CID 64876319
6-[(4-chlorophenyl)methyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane
CID 64838297
8-cyclopropyl-6-[(4-methylphenyl)methyl]-6,9-diazaspiro[4.5]decane
CID 64859965
(3S)-1-benzyl-3-phenylpiperazine
CID 51910764
(4R)-1-benzyl-1,7-diazaspiro[3.4]octane
CID 97114338
1-benzyl-1,7-diazaspiro[3.4]octane
CID 71302050

Frequently Asked Questions

What is the IUPAC name of 6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane (CID 64877476) is 6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane is c1ccc(CN2CC(c3ccccc3)NCC23CCCC3)cc1.
What is the InChIKey of 6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane?
The InChIKey is ZEDPCLBZEGLOCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2/c1-3-9-18(10-4-1)15-23-16-20(19-11-5-2-6-12-19)22-17-21(23)13-7-8-14-21/h1-6,9-12,20,22H,7-8,13-17H2.
What are the key properties of 6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane?
6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane has a molecular weight of 306.45 g/mol, XLogP of 4.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-benzyl-8-phenyl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64877476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).