9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane

C17H25ClN2 — CID 64875826

IUPAC9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane
SMILESCCC1CNC2(CCCC2)CN1Cc1ccccc1Cl
InChIInChI=1S/C17H25ClN2/c1-2-15-11-19-17(9-5-6-10-17)13-20(15)12-14-7-3-4-8-16(14)18/h3-4,7-8,15,19H,2,5-6,9-13H2,1H3
InChIKeyQGFBDWZFKJJHCR-UHFFFAOYSA-N
MW292.85 g/mol
LogP3.84
Rot. Bonds3

About 9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane

9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane (PubChem CID 64875826) has the molecular formula C17H25ClN2 and a molecular weight of 292.85 g/mol. Its IUPAC name is 9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane
PubChem CID64875826
Molecular FormulaC17H25ClN2
Molecular Weight292.85 g/mol
Exact Mass292.17
IUPAC Name9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane
SMILESCCC1CNC2(CCCC2)CN1Cc1ccccc1Cl
InChIInChI=1S/C17H25ClN2/c1-2-15-11-19-17(9-5-6-10-17)13-20(15)12-14-7-3-4-8-16(14)18/h3-4,7-8,15,19H,2,5-6,9-13H2,1H3
InChIKeyQGFBDWZFKJJHCR-UHFFFAOYSA-N
XLogP3.84
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.85
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-[(2-bromophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane
CID 64877165
9-[(2-chloro-4-fluorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane
CID 64877362
8-ethyl-9-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64875635
9-benzyl-8-propyl-6,9-diazaspiro[4.5]decane
CID 64877176
8-ethyl-9-(pyridin-3-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64876595
8-ethyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane
CID 64946171
3-methyl-4-[(2-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane
CID 64877988
2-ethyl-1-[(2-ethylphenyl)methyl]-5,5-dimethylpiperazine
CID 64940709
4-[(2-chlorophenyl)methyl]-3,3-dimethyl-1,4-diazaspiro[5.5]undecane
CID 64875519
7-benzyl-4,7-diazaspiro[2.5]octane;7-benzyl-6-ethyl-4,7-diazaspiro[2.5]octane;ethane
CID 142410738
3-benzyl-4-ethyl-1,4-diazaspiro[5.5]undecane
CID 64877822
1-[(2-chloro-4-methylphenyl)methyl]-2,5,5-triethylpiperazine
CID 106870391

Frequently Asked Questions

What is the IUPAC name of 9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane (CID 64875826) is 9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane is CCC1CNC2(CCCC2)CN1Cc1ccccc1Cl.
What is the InChIKey of 9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane?
The InChIKey is QGFBDWZFKJJHCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25ClN2/c1-2-15-11-19-17(9-5-6-10-17)13-20(15)12-14-7-3-4-8-16(14)18/h3-4,7-8,15,19H,2,5-6,9-13H2,1H3.
What are the key properties of 9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane?
9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane has a molecular weight of 292.85 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(2-chlorophenyl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64875826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).