1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone

C24H34N2O2 — CID 92633604

IUPAC1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone
SMILESO=C(Cc1ccccc1)N1CCC(CC(=O)N2CCC3(CCCCC3)C2)CC1
InChIInChI=1S/C24H34N2O2/c27-22(17-20-7-3-1-4-8-20)25-14-9-21(10-15-25)18-23(28)26-16-13-24(19-26)11-5-2-6-12-24/h1,3-4,7-8,21H,2,5-6,9-19H2
InChIKeyIEENKFAIJAJTHV-UHFFFAOYSA-N
MW382.55 g/mol
LogP4.04
Rot. Bonds4

About 1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone

1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone (PubChem CID 92633604) has the molecular formula C24H34N2O2 and a molecular weight of 382.55 g/mol. Its IUPAC name is 1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone.

Molecular Properties

Compound Name1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone
PubChem CID92633604
Molecular FormulaC24H34N2O2
Molecular Weight382.55 g/mol
Exact Mass382.26
IUPAC Name1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone
SMILESO=C(Cc1ccccc1)N1CCC(CC(=O)N2CCC3(CCCCC3)C2)CC1
InChIInChI=1S/C24H34N2O2/c27-22(17-20-7-3-1-4-8-20)25-14-9-21(10-15-25)18-23(28)26-16-13-24(19-26)11-5-2-6-12-24/h1,3-4,7-8,21H,2,5-6,9-19H2
InChIKeyIEENKFAIJAJTHV-UHFFFAOYSA-N
XLogP4.04
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.55
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(2-phenylacetyl)piperidin-4-yl]acetic acid
CID 28997512
2-(4-aminophenyl)-1-(2-azaspiro[4.5]decan-2-yl)ethanone
CID 119805305
1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-phenylethanone
CID 82038242
1-(4-benzylpiperidin-1-yl)-2-cyclopentylethanone
CID 127122886
1-[(3S)-3-[(dimethylamino)methyl]piperidin-1-yl]-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone
CID 92633659
1-[3-[(dimethylamino)methyl]piperidin-1-yl]-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone
CID 110246207
1-[4-(azepan-1-yl)piperidin-1-yl]-2-phenylethanone
CID 1121449
1-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-phenylethanone
CID 113005998
2-[1-(2-phenylacetyl)piperidin-4-yl]-1-[(2S)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone
CID 92633667
2-(1-benzylpiperidin-4-yl)-1-[(5S)-2-oxa-9-azaspiro[4.5]decan-9-yl]ethanone
CID 125170778
1-(3-azaspiro[5.5]undecan-3-yl)-2-(3-hydroxyphenyl)ethanone
CID 62865664
1-(azetidin-1-yl)-2-phenylethanone
CID 18670940

Frequently Asked Questions

What is the IUPAC name of 1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone?
The IUPAC name of 1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone (CID 92633604) is 1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone.
What is the SMILES notation for 1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone?
The canonical SMILES for 1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone is O=C(Cc1ccccc1)N1CCC(CC(=O)N2CCC3(CCCCC3)C2)CC1.
What is the InChIKey of 1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone?
The InChIKey is IEENKFAIJAJTHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34N2O2/c27-22(17-20-7-3-1-4-8-20)25-14-9-21(10-15-25)18-23(28)26-16-13-24(19-26)11-5-2-6-12-24/h1,3-4,7-8,21H,2,5-6,9-19H2.
What are the key properties of 1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone?
1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone has a molecular weight of 382.55 g/mol, XLogP of 4.04, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-azaspiro[4.5]decan-2-yl)-2-[1-(2-phenylacetyl)piperidin-4-yl]ethanone is sourced from PubChem (CID 92633604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).