2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone

C13H22N2O2 — CID 119340778

IUPAC2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone
SMILESO=C(C1CCCNC1)N1CCC2(CCOC2)C1
InChIInChI=1S/C13H22N2O2/c16-12(11-2-1-5-14-8-11)15-6-3-13(9-15)4-7-17-10-13/h11,14H,1-10H2
InChIKeyFRZXFIHVWHFWPC-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.62
Rot. Bonds1

About 2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone

2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone (PubChem CID 119340778) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone.

Molecular Properties

Compound Name2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone
PubChem CID119340778
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone
SMILESO=C(C1CCCNC1)N1CCC2(CCOC2)C1
InChIInChI=1S/C13H22N2O2/c16-12(11-2-1-5-14-8-11)15-6-3-13(9-15)4-7-17-10-13/h11,14H,1-10H2
InChIKeyFRZXFIHVWHFWPC-UHFFFAOYSA-N
XLogP0.62
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-azaspiro[3.4]octan-6-yl(azetidin-3-yl)methanone
CID 131185783
(3,3-diethylpyrrolidin-1-yl)-[(3S)-piperidin-3-yl]methanone
CID 81134714
(4,4-difluoropiperidin-1-yl)-piperidin-3-ylmethanone;hydrochloride
CID 154582456
1,4-oxazepan-4-yl-[(3S)-piperidin-3-yl]methanone
CID 81141474
azepan-1-yl-[(3S)-piperidin-3-yl]methanone
CID 7169846
azocan-1-yl(piperidin-3-yl)methanone
CID 43211901
cyclobutyl(2,9-diazaspiro[4.5]decan-2-yl)methanone
CID 134068804
3,3a,4,6,7,7a-hexahydro-1H-furo[3,4-c]pyridin-5-yl(piperidin-3-yl)methanone
CID 121202092
[4-(hydroxymethyl)-4-methylpiperidin-1-yl]-[(3R)-piperidin-3-yl]methanone
CID 129491032
8-[(3R)-piperidine-3-carbonyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 81128328
[4-(morpholin-4-ylmethyl)piperidin-1-yl]-[(3R)-piperidin-3-yl]methanone
CID 81128684
azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone
CID 50951587

Frequently Asked Questions

What is the IUPAC name of 2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone?
The IUPAC name of 2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone (CID 119340778) is 2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone.
What is the SMILES notation for 2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone?
The canonical SMILES for 2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone is O=C(C1CCCNC1)N1CCC2(CCOC2)C1.
What is the InChIKey of 2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone?
The InChIKey is FRZXFIHVWHFWPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c16-12(11-2-1-5-14-8-11)15-6-3-13(9-15)4-7-17-10-13/h11,14H,1-10H2.
What are the key properties of 2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone?
2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone has a molecular weight of 238.33 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone is sourced from PubChem (CID 119340778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).