N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide

C11H20N2O4 — CID 71907558

IUPACN-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide
SMILESCOCCNC(=O)N1CCCC2(C1)OCCO2
InChIInChI=1S/C11H20N2O4/c1-15-6-4-12-10(14)13-5-2-3-11(9-13)16-7-8-17-11/h2-9H2,1H3,(H,12,14)
InChIKeyHXKHPLVOTKKQDZ-UHFFFAOYSA-N
MW244.29 g/mol
LogP0.18
Rot. Bonds3

About N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide

N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide (PubChem CID 71907558) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide
PubChem CID71907558
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC NameN-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide
SMILESCOCCNC(=O)N1CCCC2(C1)OCCO2
InChIInChI=1S/C11H20N2O4/c1-15-6-4-12-10(14)13-5-2-3-11(9-13)16-7-8-17-11/h2-9H2,1H3,(H,12,14)
InChIKeyHXKHPLVOTKKQDZ-UHFFFAOYSA-N
XLogP0.18
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide (CID 71907558) is N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide is COCCNC(=O)N1CCCC2(C1)OCCO2.
What is the InChIKey of N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide?
The InChIKey is HXKHPLVOTKKQDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4/c1-15-6-4-12-10(14)13-5-2-3-11(9-13)16-7-8-17-11/h2-9H2,1H3,(H,12,14).
What are the key properties of N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide?
N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide has a molecular weight of 244.29 g/mol, XLogP of 0.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-1,4-dioxa-9-azaspiro[4.5]decane-9-carboxamide is sourced from PubChem (CID 71907558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).