5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one

C15H28N2O — CID 82852237

IUPAC5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one
SMILESCC(N)CCCC(=O)N1CCC2(CCCC2)CC1
InChIInChI=1S/C15H28N2O/c1-13(16)5-4-6-14(18)17-11-9-15(10-12-17)7-2-3-8-15/h13H,2-12,16H2,1H3
InChIKeyMNXAZKQBOYROSN-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.69
Rot. Bonds4

About 5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one

5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one (PubChem CID 82852237) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one.

Molecular Properties

Compound Name5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one
PubChem CID82852237
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one
SMILESCC(N)CCCC(=O)N1CCC2(CCCC2)CC1
InChIInChI=1S/C15H28N2O/c1-13(16)5-4-6-14(18)17-11-9-15(10-12-17)7-2-3-8-15/h13H,2-12,16H2,1H3
InChIKeyMNXAZKQBOYROSN-UHFFFAOYSA-N
XLogP2.69
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-amino-1-(4-ethyl-4-methylpiperidin-1-yl)hexan-1-one
CID 82852140
1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one
CID 63163607
5-amino-1-(1,4-diazepan-1-yl)hexan-1-one
CID 82848388
1-(3-azaspiro[5.5]undecan-3-yl)-4-(methylamino)butan-1-one
CID 62930046
6-(3-azaspiro[5.5]undecan-3-yl)-6-oxohexanoic acid
CID 62936033
5-(3-azaspiro[5.5]undecan-3-yl)-5-oxopentanoic acid
CID 62936546
3-amino-1-(3-azaspiro[5.5]undecan-3-yl)propan-1-one
CID 62937582
5-amino-1-(3,6-dihydro-2H-pyridin-1-yl)hexan-1-one
CID 114409070
4-amino-1-(3-azaspiro[5.5]undecan-3-yl)-3-methylbutan-1-one
CID 81079240
5-amino-1-(3,3,4-trimethylpiperazin-1-yl)hexan-1-one
CID 82851488
2-[1-(5-aminohexanoyl)piperidin-4-yl]oxyacetic acid
CID 82851206
(2S)-2-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one
CID 95023526

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one?
The IUPAC name of 5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one (CID 82852237) is 5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one.
What is the SMILES notation for 5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one?
The canonical SMILES for 5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one is CC(N)CCCC(=O)N1CCC2(CCCC2)CC1.
What is the InChIKey of 5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one?
The InChIKey is MNXAZKQBOYROSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-13(16)5-4-6-14(18)17-11-9-15(10-12-17)7-2-3-8-15/h13H,2-12,16H2,1H3.
What are the key properties of 5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one?
5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one has a molecular weight of 252.40 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one is sourced from PubChem (CID 82852237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).