5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one

C11H21N3O — CID 172698253

IUPAC5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one
SMILESCC1(C)CNC(=O)N(N2CCCCC2)C1
InChIInChI=1S/C11H21N3O/c1-11(2)8-12-10(15)14(9-11)13-6-4-3-5-7-13/h3-9H2,1-2H3,(H,12,15)
InChIKeyCPPFAKJUIYUASD-UHFFFAOYSA-N
MW211.31 g/mol
LogP1.44
Rot. Bonds1

About 5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one

5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one (PubChem CID 172698253) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one.

Molecular Properties

Compound Name5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one
PubChem CID172698253
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one
SMILESCC1(C)CNC(=O)N(N2CCCCC2)C1
InChIInChI=1S/C11H21N3O/c1-11(2)8-12-10(15)14(9-11)13-6-4-3-5-7-13/h3-9H2,1-2H3,(H,12,15)
InChIKeyCPPFAKJUIYUASD-UHFFFAOYSA-N
XLogP1.44
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-aminophenyl)-5,5-dimethyl-1,3-diazinan-2-one
CID 82276547
2,8-dimethyl-1,4,8-triazaspiro[5.5]undecan-3-one
CID 82398724
3-piperidin-1-ylimidazolidine-2,4-dione
CID 107842327
1-methyl-4-piperidin-1-ylpiperazin-2-one
CID 91056242
(8aS)-1',1'-dimethylspiro[2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-4,4'-cyclohexane]-1-one
CID 96594376
3-(azepan-1-yl)-1,3-oxazolidin-2-one
CID 130355886
6,6,13,13,20,20,27,27-octamethyl-1,4,8,11,15,18,22,25-octazacyclooctacosane-2,3,16,17-tetrone
CID 10897072
1-(2,2,3,3-tetramethylcyclopropyl)-1,3-diazinan-2-one
CID 115371267
4-cyclohexyl-6,6-dimethylpiperazin-2-one
CID 117023924
1,7-diazabicyclo[5.2.1]decan-10-one
CID 90224464
4-(3,3-dimethylpiperidine-1-carbonyl)pyrrolidin-2-one
CID 78957612
1,7,7-trimethyl-1,4-diazocan-5-one
CID 172596220

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one?
The IUPAC name of 5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one (CID 172698253) is 5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one.
What is the SMILES notation for 5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one?
The canonical SMILES for 5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one is CC1(C)CNC(=O)N(N2CCCCC2)C1.
What is the InChIKey of 5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one?
The InChIKey is CPPFAKJUIYUASD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-11(2)8-12-10(15)14(9-11)13-6-4-3-5-7-13/h3-9H2,1-2H3,(H,12,15).
What are the key properties of 5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one?
5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one has a molecular weight of 211.31 g/mol, XLogP of 1.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-1-piperidin-1-yl-1,3-diazinan-2-one is sourced from PubChem (CID 172698253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).