N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide

C11H20N2O2 — CID 118739092

IUPACN-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide
SMILESCC(C)NC(=O)N1CCC2(CCCO2)C1
InChIInChI=1S/C11H20N2O2/c1-9(2)12-10(14)13-6-5-11(8-13)4-3-7-15-11/h9H,3-8H2,1-2H3,(H,12,14)
InChIKeyBTYYTDROHOREME-UHFFFAOYSA-N
MW212.29 g/mol
LogP1.36
Rot. Bonds1

About N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide

N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide (PubChem CID 118739092) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide
PubChem CID118739092
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide
SMILESCC(C)NC(=O)N1CCC2(CCCO2)C1
InChIInChI=1S/C11H20N2O2/c1-9(2)12-10(14)13-6-5-11(8-13)4-3-7-15-11/h9H,3-8H2,1-2H3,(H,12,14)
InChIKeyBTYYTDROHOREME-UHFFFAOYSA-N
XLogP1.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide?
The IUPAC name of N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide (CID 118739092) is N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide.
What is the SMILES notation for N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide?
The canonical SMILES for N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide is CC(C)NC(=O)N1CCC2(CCCO2)C1.
What is the InChIKey of N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide?
The InChIKey is BTYYTDROHOREME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-9(2)12-10(14)13-6-5-11(8-13)4-3-7-15-11/h9H,3-8H2,1-2H3,(H,12,14).
What are the key properties of N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide?
N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide has a molecular weight of 212.29 g/mol, XLogP of 1.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide is sourced from PubChem (CID 118739092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).