N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide

C12H22N2O2 — CID 123513564

IUPACN-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide
SMILESCC(=O)NC1CCOC2(CCN(C)CC2)C1
InChIInChI=1S/C12H22N2O2/c1-10(15)13-11-3-8-16-12(9-11)4-6-14(2)7-5-12/h11H,3-9H2,1-2H3,(H,13,15)
InChIKeyFCYZSGLWGGTKFO-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.77
Rot. Bonds1

About N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide

N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide (PubChem CID 123513564) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide.

Molecular Properties

Compound NameN-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide
PubChem CID123513564
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide
SMILESCC(=O)NC1CCOC2(CCN(C)CC2)C1
InChIInChI=1S/C12H22N2O2/c1-10(15)13-11-3-8-16-12(9-11)4-6-14(2)7-5-12/h11H,3-9H2,1-2H3,(H,13,15)
InChIKeyFCYZSGLWGGTKFO-UHFFFAOYSA-N
XLogP0.77
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide?
The IUPAC name of N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide (CID 123513564) is N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide.
What is the SMILES notation for N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide?
The canonical SMILES for N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide is CC(=O)NC1CCOC2(CCN(C)CC2)C1.
What is the InChIKey of N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide?
The InChIKey is FCYZSGLWGGTKFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-10(15)13-11-3-8-16-12(9-11)4-6-14(2)7-5-12/h11H,3-9H2,1-2H3,(H,13,15).
What are the key properties of N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide?
N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide has a molecular weight of 226.32 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl)acetamide is sourced from PubChem (CID 123513564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).