3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one

C15H26N2O2 — CID 79895755

IUPAC3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one
SMILESO=C1NCCCC1NC1CCOC2(CCCCC2)C1
InChIInChI=1S/C15H26N2O2/c18-14-13(5-4-9-16-14)17-12-6-10-19-15(11-12)7-2-1-3-8-15/h12-13,17H,1-11H2,(H,16,18)
InChIKeyDRBOURMJRCNUBF-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.74
Rot. Bonds2

About 3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one

3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one (PubChem CID 79895755) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one.

Molecular Properties

Compound Name3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one
PubChem CID79895755
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one
SMILESO=C1NCCCC1NC1CCOC2(CCCCC2)C1
InChIInChI=1S/C15H26N2O2/c18-14-13(5-4-9-16-14)17-12-6-10-19-15(11-12)7-2-1-3-8-15/h12-13,17H,1-11H2,(H,16,18)
InChIKeyDRBOURMJRCNUBF-UHFFFAOYSA-N
XLogP1.74
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-(1-oxaspiro[5.5]undecan-4-ylamino)pyrrolidin-2-one
CID 103792111
N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine
CID 79895616
N-cyclohexyl-1-oxaspiro[5.5]undecan-4-amine
CID 79898516
1-methyl-3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidine-2,6-dione
CID 79900518
3-(spiro[3.5]nonan-3-ylamino)piperidin-2-one
CID 102951791
3-[(1,1-dioxothian-4-yl)amino]piperidin-2-one
CID 62093934
3-(oxepan-4-ylamino)azepan-2-one
CID 65081835
N-(thian-3-yl)-1-oxaspiro[5.5]undecan-4-amine
CID 86811515
N-(1-methylcyclopentyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79895290
3-[(3-methylcyclohexyl)amino]piperidin-2-one
CID 62092837
3-[(3,5-dimethylcyclohexyl)amino]piperidin-2-one
CID 64751431
N-(1-ethylcyclobutyl)-1-oxaspiro[5.5]undecan-4-amine
CID 113488726

Frequently Asked Questions

What is the IUPAC name of 3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one?
The IUPAC name of 3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one (CID 79895755) is 3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one.
What is the SMILES notation for 3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one?
The canonical SMILES for 3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one is O=C1NCCCC1NC1CCOC2(CCCCC2)C1.
What is the InChIKey of 3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one?
The InChIKey is DRBOURMJRCNUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c18-14-13(5-4-9-16-14)17-12-6-10-19-15(11-12)7-2-1-3-8-15/h12-13,17H,1-11H2,(H,16,18).
What are the key properties of 3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one?
3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one has a molecular weight of 266.38 g/mol, XLogP of 1.74, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-oxaspiro[5.5]undecan-4-ylamino)piperidin-2-one is sourced from PubChem (CID 79895755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).