5-cyclopentyl-1,5-oxazocane

C11H21NO — CID 174168377

IUPAC5-cyclopentyl-1,5-oxazocane
SMILESC1CCC(N2CCCOCCC2)C1
InChIInChI=1S/C11H21NO/c1-2-6-11(5-1)12-7-3-9-13-10-4-8-12/h11H,1-10H2
InChIKeyYWNUPESRLMUQPS-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.04
Rot. Bonds1

About 5-cyclopentyl-1,5-oxazocane

5-cyclopentyl-1,5-oxazocane (PubChem CID 174168377) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 5-cyclopentyl-1,5-oxazocane.

Molecular Properties

Compound Name5-cyclopentyl-1,5-oxazocane
PubChem CID174168377
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name5-cyclopentyl-1,5-oxazocane
SMILESC1CCC(N2CCCOCCC2)C1
InChIInChI=1S/C11H21NO/c1-2-6-11(5-1)12-7-3-9-13-10-4-8-12/h11H,1-10H2
InChIKeyYWNUPESRLMUQPS-UHFFFAOYSA-N
XLogP2.04
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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1,3,4,5,7,8,9,9a-octahydropyrrolo[2,1-c][1,4]oxazepine
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1-cyclooctylpiperidine
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1-cyclohexylazocane
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1-cyclohexylpiperidine;methane
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CID 175727151
CID 175727151
1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine
CID 23278629
1-(oxocan-4-yl)-4-propan-2-ylpiperazine
CID 146561161
4-(1-cyclopentylpiperidin-4-yl)morpholine;oxalic acid
CID 17369368
(12R,23R)-14,21-dioxa-1,8-diazatricyclo[21.3.0.08,12]hexacosane
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Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-1,5-oxazocane?
The IUPAC name of 5-cyclopentyl-1,5-oxazocane (CID 174168377) is 5-cyclopentyl-1,5-oxazocane.
What is the SMILES notation for 5-cyclopentyl-1,5-oxazocane?
The canonical SMILES for 5-cyclopentyl-1,5-oxazocane is C1CCC(N2CCCOCCC2)C1.
What is the InChIKey of 5-cyclopentyl-1,5-oxazocane?
The InChIKey is YWNUPESRLMUQPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-2-6-11(5-1)12-7-3-9-13-10-4-8-12/h11H,1-10H2.
What are the key properties of 5-cyclopentyl-1,5-oxazocane?
5-cyclopentyl-1,5-oxazocane has a molecular weight of 183.29 g/mol, XLogP of 2.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-1,5-oxazocane is sourced from PubChem (CID 174168377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).