(5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide

C16H24N2O4 — CID 97273108

IUPAC(5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
SMILESCO[C@@H]1CCCOC12CCN(C(=O)NCc1ccco1)CC2
InChIInChI=1S/C16H24N2O4/c1-20-14-5-3-11-22-16(14)6-8-18(9-7-16)15(19)17-12-13-4-2-10-21-13/h2,4,10,14H,3,5-9,11-12H2,1H3,(H,17,19)/t14-/m1/s1
InChIKeyOESJQOPJTFLBME-CQSZACIVSA-N
MW308.38 g/mol
LogP2.15
Rot. Bonds3

About (5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide

(5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide (PubChem CID 97273108) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is (5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide.

Molecular Properties

Compound Name(5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
PubChem CID97273108
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC Name(5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
SMILESCO[C@@H]1CCCOC12CCN(C(=O)NCc1ccco1)CC2
InChIInChI=1S/C16H24N2O4/c1-20-14-5-3-11-22-16(14)6-8-18(9-7-16)15(19)17-12-13-4-2-10-21-13/h2,4,10,14H,3,5-9,11-12H2,1H3,(H,17,19)/t14-/m1/s1
InChIKeyOESJQOPJTFLBME-CQSZACIVSA-N
XLogP2.15
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
The IUPAC name of (5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide (CID 97273108) is (5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide.
What is the SMILES notation for (5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
The canonical SMILES for (5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide is CO[C@@H]1CCCOC12CCN(C(=O)NCc1ccco1)CC2.
What is the InChIKey of (5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
The InChIKey is OESJQOPJTFLBME-CQSZACIVSA-N. The full InChI is InChI=1S/C16H24N2O4/c1-20-14-5-3-11-22-16(14)6-8-18(9-7-16)15(19)17-12-13-4-2-10-21-13/h2,4,10,14H,3,5-9,11-12H2,1H3,(H,17,19)/t14-/m1/s1.
What are the key properties of (5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
(5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-N-(furan-2-ylmethyl)-5-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide is sourced from PubChem (CID 97273108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).