1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one

C15H28N2O — CID 63163607

IUPAC1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one
SMILESCC(C)NCCC(=O)N1CCC2(CCCC2)CC1
InChIInChI=1S/C15H28N2O/c1-13(2)16-10-5-14(18)17-11-8-15(9-12-17)6-3-4-7-15/h13,16H,3-12H2,1-2H3
InChIKeyRVDMQWZZJSHMQV-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.56
Rot. Bonds4

About 1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one

1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one (PubChem CID 63163607) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one.

Molecular Properties

Compound Name1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one
PubChem CID63163607
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one
SMILESCC(C)NCCC(=O)N1CCC2(CCCC2)CC1
InChIInChI=1S/C15H28N2O/c1-13(2)16-10-5-14(18)17-11-8-15(9-12-17)6-3-4-7-15/h13,16H,3-12H2,1-2H3
InChIKeyRVDMQWZZJSHMQV-UHFFFAOYSA-N
XLogP2.56
TPSA32.34 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 ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4,4-dimethylpiperidin-1-yl)-3-(propan-2-ylamino)propan-1-one
CID 62930053
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one
CID 109011707
1-(3-azaspiro[5.5]undecan-3-yl)-4-(methylamino)butan-1-one
CID 62930046
1-morpholin-4-yl-3-(propan-2-ylamino)propan-1-one
CID 60853589
5-amino-1-(8-azaspiro[4.5]decan-8-yl)hexan-1-one
CID 82852237
1-[4-(1-hydroxyethyl)piperidin-1-yl]-3-(propan-2-ylamino)propan-1-one
CID 113264108
3-amino-1-(3-azaspiro[5.5]undecan-3-yl)propan-1-one
CID 62937582
1-(8-azaspiro[4.6]undecan-8-yl)-2-chloroethanone
CID 167588263
5-(3-azaspiro[5.5]undecan-3-yl)-5-oxopentanoic acid
CID 62936546
6-(3-azaspiro[5.5]undecan-3-yl)-6-oxohexanoic acid
CID 62936033
2-(propan-2-ylamino)-1-(2-propan-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone
CID 156517459
4-amino-1-(3-azaspiro[5.5]undecan-3-yl)-3-methylbutan-1-one
CID 81079240

Frequently Asked Questions

What is the IUPAC name of 1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one?
The IUPAC name of 1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one (CID 63163607) is 1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one.
What is the SMILES notation for 1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one?
The canonical SMILES for 1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one is CC(C)NCCC(=O)N1CCC2(CCCC2)CC1.
What is the InChIKey of 1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one?
The InChIKey is RVDMQWZZJSHMQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-13(2)16-10-5-14(18)17-11-8-15(9-12-17)6-3-4-7-15/h13,16H,3-12H2,1-2H3.
What are the key properties of 1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one?
1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one has a molecular weight of 252.40 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-azaspiro[4.5]decan-8-yl)-3-(propan-2-ylamino)propan-1-one is sourced from PubChem (CID 63163607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).