N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide

C15H26N2O3 — CID 163299163

IUPACN-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide
SMILESCCC(CCOC)C(=O)NC(=O)C1CC12CCNCC2
InChIInChI=1S/C15H26N2O3/c1-3-11(4-9-20-2)13(18)17-14(19)12-10-15(12)5-7-16-8-6-15/h11-12,16H,3-10H2,1-2H3,(H,17,18,19)
InChIKeyOJBSLETWIBWJSB-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.08
Rot. Bonds6

About N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide

N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide (PubChem CID 163299163) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide
PubChem CID163299163
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC NameN-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide
SMILESCCC(CCOC)C(=O)NC(=O)C1CC12CCNCC2
InChIInChI=1S/C15H26N2O3/c1-3-11(4-9-20-2)13(18)17-14(19)12-10-15(12)5-7-16-8-6-15/h11-12,16H,3-10H2,1-2H3,(H,17,18,19)
InChIKeyOJBSLETWIBWJSB-UHFFFAOYSA-N
XLogP1.08
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide?
The IUPAC name of N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide (CID 163299163) is N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide.
What is the SMILES notation for N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide?
The canonical SMILES for N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide is CCC(CCOC)C(=O)NC(=O)C1CC12CCNCC2.
What is the InChIKey of N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide?
The InChIKey is OJBSLETWIBWJSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-3-11(4-9-20-2)13(18)17-14(19)12-10-15(12)5-7-16-8-6-15/h11-12,16H,3-10H2,1-2H3,(H,17,18,19).
What are the key properties of N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide?
N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide has a molecular weight of 282.38 g/mol, XLogP of 1.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide is sourced from PubChem (CID 163299163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).