(5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine

C11H17N3O — CID 146477518

IUPAC(5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine
SMILESCN1CCC2(CC1)c1cnoc1C[C@H]2N
InChIInChI=1S/C11H17N3O/c1-14-4-2-11(3-5-14)8-7-13-15-9(8)6-10(11)12/h7,10H,2-6,12H2,1H3/t10-/m1/s1
InChIKeyOGBIJPLLTIVDMR-SNVBAGLBSA-N
MW207.28 g/mol
LogP0.52
Rot. Bonds

About (5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine

(5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine (PubChem CID 146477518) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is (5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine.

Molecular Properties

Compound Name(5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine
PubChem CID146477518
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name(5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine
SMILESCN1CCC2(CC1)c1cnoc1C[C@H]2N
InChIInChI=1S/C11H17N3O/c1-14-4-2-11(3-5-14)8-7-13-15-9(8)6-10(11)12/h7,10H,2-6,12H2,1H3/t10-/m1/s1
InChIKeyOGBIJPLLTIVDMR-SNVBAGLBSA-N
XLogP0.52
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine?
The IUPAC name of (5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine (CID 146477518) is (5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine.
What is the SMILES notation for (5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine?
The canonical SMILES for (5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine is CN1CCC2(CC1)c1cnoc1C[C@H]2N.
What is the InChIKey of (5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine?
The InChIKey is OGBIJPLLTIVDMR-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H17N3O/c1-14-4-2-11(3-5-14)8-7-13-15-9(8)6-10(11)12/h7,10H,2-6,12H2,1H3/t10-/m1/s1.
What are the key properties of (5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine?
(5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine has a molecular weight of 207.28 g/mol, XLogP of 0.52, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-1'-methylspiro[5,6-dihydrocyclopenta[d][1,2]oxazole-4,4'-piperidine]-5-amine is sourced from PubChem (CID 146477518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).