1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone

C15H20N2O — CID 82038242

IUPAC1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone
SMILESO=C(Cc1ccccc1)N1CCC2(CCNC2)C1
InChIInChI=1S/C15H20N2O/c18-14(10-13-4-2-1-3-5-13)17-9-7-15(12-17)6-8-16-11-15/h1-5,16H,6-12H2
InChIKeyRJZCJXYIVJBPCA-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.44
Rot. Bonds2

About 1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone

1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone (PubChem CID 82038242) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone.

Molecular Properties

Compound Name1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone
PubChem CID82038242
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone
SMILESO=C(Cc1ccccc1)N1CCC2(CCNC2)C1
InChIInChI=1S/C15H20N2O/c18-14(10-13-4-2-1-3-5-13)17-9-7-15(12-17)6-8-16-11-15/h1-5,16H,6-12H2
InChIKeyRJZCJXYIVJBPCA-UHFFFAOYSA-N
XLogP1.44
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-(4-fluorophenyl)ethanone
CID 82038211
1-(2,7-diazaspiro[4.4]nonan-2-yl)-3-(4-hydroxyphenyl)propan-1-one
CID 82038184
1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-(2-methoxyphenoxy)ethanone
CID 82038149
1-(2,8-diazaspiro[5.5]undecan-2-yl)-2-(4-hydroxyphenyl)ethanone
CID 82038156
2,7-diazaspiro[4.4]nonan-2-yl-(1-phenylcyclobutyl)methanone
CID 82038165
1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone
CID 92633604
(2-chlorophenyl)-(2,7-diazaspiro[4.4]nonan-2-yl)methanone
CID 82038205
(5R)-2-benzyl-2,7-diazaspiro[4.4]nonane
CID 34178522
1-(2,8-diazaspiro[4.5]decan-8-yl)-2-(1H-pyrrol-2-yl)ethanone
CID 115276479
benzyl 2,8-diazaspiro[4.5]decane-2-carboxylate
CID 66570416
2,7-diazaspiro[4.4]nonan-2-yl-(2-fluorophenyl)methanone
CID 82038235
2-(1-adamantyl)acetyl chloride;2-(1-adamantyl)-1-(7-benzyl-2,7-diazaspiro[4.4]nonan-2-yl)ethanone;2-benzyl-2,7-diazaspiro[4.4]nonane;dichloromethane;methane
CID 158558270

Frequently Asked Questions

What is the IUPAC name of 1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone?
The IUPAC name of 1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone (CID 82038242) is 1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone.
What is the SMILES notation for 1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone?
The canonical SMILES for 1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone is O=C(Cc1ccccc1)N1CCC2(CCNC2)C1.
What is the InChIKey of 1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone?
The InChIKey is RJZCJXYIVJBPCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c18-14(10-13-4-2-1-3-5-13)17-9-7-15(12-17)6-8-16-11-15/h1-5,16H,6-12H2.
What are the key properties of 1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone?
1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone has a molecular weight of 244.34 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone is sourced from PubChem (CID 82038242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).