(6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane

C11H21NO — CID 146518650

IUPAC(6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane
SMILESCC[C@@H]1CC2(CCO2)CN1C(C)C
InChIInChI=1S/C11H21NO/c1-4-10-7-11(5-6-13-11)8-12(10)9(2)3/h9-10H,4-8H2,1-3H3/t10-,11?/m1/s1
InChIKeyQDRLYUHFIOYZPW-NFJWQWPMSA-N
MW183.29 g/mol
LogP2.04
Rot. Bonds2

About (6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane

(6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane (PubChem CID 146518650) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is (6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane.

Molecular Properties

Compound Name(6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane
PubChem CID146518650
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name(6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane
SMILESCC[C@@H]1CC2(CCO2)CN1C(C)C
InChIInChI=1S/C11H21NO/c1-4-10-7-11(5-6-13-11)8-12(10)9(2)3/h9-10H,4-8H2,1-3H3/t10-,11?/m1/s1
InChIKeyQDRLYUHFIOYZPW-NFJWQWPMSA-N
XLogP2.04
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
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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Frequently Asked Questions

What is the IUPAC name of (6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane?
The IUPAC name of (6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane (CID 146518650) is (6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane.
What is the SMILES notation for (6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane?
The canonical SMILES for (6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane is CC[C@@H]1CC2(CCO2)CN1C(C)C.
What is the InChIKey of (6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane?
The InChIKey is QDRLYUHFIOYZPW-NFJWQWPMSA-N. The full InChI is InChI=1S/C11H21NO/c1-4-10-7-11(5-6-13-11)8-12(10)9(2)3/h9-10H,4-8H2,1-3H3/t10-,11?/m1/s1.
What are the key properties of (6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane?
(6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane has a molecular weight of 183.29 g/mol, XLogP of 2.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane is sourced from PubChem (CID 146518650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).