2,2,6,6-tetramethyl(115N)azinan-4-one

C9H17NO — CID 10888153

IUPAC2,2,6,6-tetramethyl(115N)azinan-4-one
SMILESCC1(C)CC(=O)CC(C)(C)[15NH]1
InChIInChI=1S/C9H17NO/c1-8(2)5-7(11)6-9(3,4)10-8/h10H,5-6H2,1-4H3/i10+1
InChIKeyJWUXJYZVKZKLTJ-DETAZLGJSA-N
MW156.23 g/mol
LogP1.50
Rot. Bonds

About 2,2,6,6-tetramethyl(115N)azinan-4-one

2,2,6,6-tetramethyl(115N)azinan-4-one (PubChem CID 10888153) has the molecular formula C9H17NO and a molecular weight of 156.23 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl(115N)azinan-4-one.

Molecular Properties

Compound Name2,2,6,6-tetramethyl(115N)azinan-4-one
PubChem CID10888153
Molecular FormulaC9H17NO
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2,2,6,6-tetramethyl(115N)azinan-4-one
SMILESCC1(C)CC(=O)CC(C)(C)[15NH]1
InChIInChI=1S/C9H17NO/c1-8(2)5-7(11)6-9(3,4)10-8/h10H,5-6H2,1-4H3/i10+1
InChIKeyJWUXJYZVKZKLTJ-DETAZLGJSA-N
XLogP1.50
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl(115N)azinan-4-one?
The IUPAC name of 2,2,6,6-tetramethyl(115N)azinan-4-one (CID 10888153) is 2,2,6,6-tetramethyl(115N)azinan-4-one.
What is the SMILES notation for 2,2,6,6-tetramethyl(115N)azinan-4-one?
The canonical SMILES for 2,2,6,6-tetramethyl(115N)azinan-4-one is CC1(C)CC(=O)CC(C)(C)[15NH]1.
What is the InChIKey of 2,2,6,6-tetramethyl(115N)azinan-4-one?
The InChIKey is JWUXJYZVKZKLTJ-DETAZLGJSA-N. The full InChI is InChI=1S/C9H17NO/c1-8(2)5-7(11)6-9(3,4)10-8/h10H,5-6H2,1-4H3/i10+1.
What are the key properties of 2,2,6,6-tetramethyl(115N)azinan-4-one?
2,2,6,6-tetramethyl(115N)azinan-4-one has a molecular weight of 156.23 g/mol, XLogP of 1.50, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl(115N)azinan-4-one is sourced from PubChem (CID 10888153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).