1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone

C15H27N3O — CID 63163322

IUPAC1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone
SMILESO=C(CN1CCNCC1)N1CCC2(CCCC2)CC1
InChIInChI=1S/C15H27N3O/c19-14(13-17-11-7-16-8-12-17)18-9-5-15(6-10-18)3-1-2-4-15/h16H,1-13H2
InChIKeyMMENQWAHQKDJRR-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.07
Rot. Bonds2

About 1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone

1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone (PubChem CID 63163322) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone.

Molecular Properties

Compound Name1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone
PubChem CID63163322
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone
SMILESO=C(CN1CCNCC1)N1CCC2(CCCC2)CC1
InChIInChI=1S/C15H27N3O/c19-14(13-17-11-7-16-8-12-17)18-9-5-15(6-10-18)3-1-2-4-15/h16H,1-13H2
InChIKeyMMENQWAHQKDJRR-UHFFFAOYSA-N
XLogP1.07
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,9-diazaspiro[5.5]undecan-3-yl)-2-(4-ethylpiperazin-1-yl)ethanone;dihydrochloride
CID 154888181
1-piperazin-1-yl-2-pyrrolidin-1-ylethanone
CID 13057079
1-[2-(1,4-diazepan-1-yl)acetyl]-4-ethylpiperidine-4-carboxylic acid
CID 63125536
1-(1,4-diazepan-1-yl)-2-(4,4-diethylpiperidin-1-yl)ethanone
CID 63160661
3-amino-1-(3-azaspiro[5.5]undecan-3-yl)propan-1-one
CID 62937582
1-(3-azaspiro[5.5]undecan-3-yl)-2-(azetidin-3-yl)ethanone
CID 64609584
1-(8-azaspiro[4.6]undecan-8-yl)-2-chloroethanone
CID 167588263
1-[2-(3,9-diazaspiro[5.5]undecan-3-yl)-2-oxoethyl]piperidin-2-one
CID 56869293
N,3-dimethyl-1-(2-piperazin-1-ylacetyl)pyrrolidine-3-carboxamide
CID 106318287
4-(2-oxo-2-piperazin-1-ylethyl)piperazine-2,6-dione
CID 66084891
2-(1,4-diazepan-1-yl)-1-(4-methyl-1,4-diazepan-1-yl)ethanone
CID 55123228
1-(3-azaspiro[5.5]undecan-3-yl)-2-piperidin-3-ylethanone
CID 62932288

Frequently Asked Questions

What is the IUPAC name of 1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone?
The IUPAC name of 1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone (CID 63163322) is 1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone.
What is the SMILES notation for 1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone?
The canonical SMILES for 1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone is O=C(CN1CCNCC1)N1CCC2(CCCC2)CC1.
What is the InChIKey of 1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone?
The InChIKey is MMENQWAHQKDJRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c19-14(13-17-11-7-16-8-12-17)18-9-5-15(6-10-18)3-1-2-4-15/h16H,1-13H2.
What are the key properties of 1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone?
1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone has a molecular weight of 265.40 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-azaspiro[4.5]decan-8-yl)-2-piperazin-1-ylethanone is sourced from PubChem (CID 63163322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).