N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide

C11H20N2O3 — CID 6470206

IUPACN-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
SMILESCCCNC(=O)N1CCC2(CC1)OCCO2
InChIInChI=1S/C11H20N2O3/c1-2-5-12-10(14)13-6-3-11(4-7-13)15-8-9-16-11/h2-9H2,1H3,(H,12,14)
InChIKeyPSDQUDJFFSIAHL-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.94
Rot. Bonds2

About N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide

N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide (PubChem CID 6470206) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound NameN-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
PubChem CID6470206
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
SMILESCCCNC(=O)N1CCC2(CC1)OCCO2
InChIInChI=1S/C11H20N2O3/c1-2-5-12-10(14)13-6-3-11(4-7-13)15-8-9-16-11/h2-9H2,1H3,(H,12,14)
InChIKeyPSDQUDJFFSIAHL-UHFFFAOYSA-N
XLogP0.94
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
The IUPAC name of N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide (CID 6470206) is N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide is CCCNC(=O)N1CCC2(CC1)OCCO2.
What is the InChIKey of N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
The InChIKey is PSDQUDJFFSIAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-2-5-12-10(14)13-6-3-11(4-7-13)15-8-9-16-11/h2-9H2,1H3,(H,12,14).
What are the key properties of N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide?
N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide has a molecular weight of 228.29 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 6470206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).