N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide

C13H24N2O2 — CID 110203878

IUPACN-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
SMILESCC(C)NC(=O)N1CCC2(CCCCO2)CC1
InChIInChI=1S/C13H24N2O2/c1-11(2)14-12(16)15-8-6-13(7-9-15)5-3-4-10-17-13/h11H,3-10H2,1-2H3,(H,14,16)
InChIKeyUNCSGEDEAJNXBO-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.14
Rot. Bonds1

About N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide

N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide (PubChem CID 110203878) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
PubChem CID110203878
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
SMILESCC(C)NC(=O)N1CCC2(CCCCO2)CC1
InChIInChI=1S/C13H24N2O2/c1-11(2)14-12(16)15-8-6-13(7-9-15)5-3-4-10-17-13/h11H,3-10H2,1-2H3,(H,14,16)
InChIKeyUNCSGEDEAJNXBO-UHFFFAOYSA-N
XLogP2.14
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.14
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-9-azaspiro[5.5]undecane-9-carboxamide?
The IUPAC name of N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide (CID 110203878) is N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide.
What is the SMILES notation for N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
The canonical SMILES for N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide is CC(C)NC(=O)N1CCC2(CCCCO2)CC1.
What is the InChIKey of N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
The InChIKey is UNCSGEDEAJNXBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-11(2)14-12(16)15-8-6-13(7-9-15)5-3-4-10-17-13/h11H,3-10H2,1-2H3,(H,14,16).
What are the key properties of N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
N-propan-2-yl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 2.14, 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-9-azaspiro[5.5]undecane-9-carboxamide is sourced from PubChem (CID 110203878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).