1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one

C10H19N3O — CID 106996405

IUPAC1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one
SMILESCC1CC(N2CCCNC2=O)CCN1
InChIInChI=1S/C10H19N3O/c1-8-7-9(3-5-11-8)13-6-2-4-12-10(13)14/h8-9,11H,2-7H2,1H3,(H,12,14)
InChIKeyYPOJWLYITOPZGP-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.54
Rot. Bonds1

About 1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one

1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one (PubChem CID 106996405) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one.

Molecular Properties

Compound Name1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one
PubChem CID106996405
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one
SMILESCC1CC(N2CCCNC2=O)CCN1
InChIInChI=1S/C10H19N3O/c1-8-7-9(3-5-11-8)13-6-2-4-12-10(13)14/h8-9,11H,2-7H2,1H3,(H,12,14)
InChIKeyYPOJWLYITOPZGP-UHFFFAOYSA-N
XLogP0.54
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-oxo-1,3-diazinan-1-yl)cyclopentane-1-carboxylic acid
CID 66032376
1-(3,4-dimethylcyclohexyl)imidazolidin-2-one
CID 115370706
1-(4-aminocyclohexyl)-1,3-diazinan-2-one
CID 62587357
1-(2-methylpiperidin-4-yl)pyrrolidine-2,5-dione
CID 106996346
1-(1-cyclopropylpyrrolidin-3-yl)-1,3-diazinan-2-one
CID 115371023
1-[(3R)-piperidin-3-yl]-1,3-diazinan-2-one;hydrochloride
CID 162422983
1-(4-propylcyclohexyl)-1,3-diazinan-2-one
CID 115371043
(2R,4S)-2-methyl-4-pyrrolidin-1-ylpiperidine;dihydrochloride
CID 67314544
(5S,13S,21S)-1,3,9,11,17,19-hexazatetracyclo[19.3.0.05,9.013,17]tetracosane-2,10,18-trione
CID 71124222
(7aR)-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one
CID 119094860
tert-butyl 4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxylate
CID 53432568
1-(2,2,3,3-tetramethylcyclopropyl)-1,3-diazinan-2-one
CID 115371267

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one?
The IUPAC name of 1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one (CID 106996405) is 1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one.
What is the SMILES notation for 1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one?
The canonical SMILES for 1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one is CC1CC(N2CCCNC2=O)CCN1.
What is the InChIKey of 1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one?
The InChIKey is YPOJWLYITOPZGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-8-7-9(3-5-11-8)13-6-2-4-12-10(13)14/h8-9,11H,2-7H2,1H3,(H,12,14).
What are the key properties of 1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one?
1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one has a molecular weight of 197.28 g/mol, XLogP of 0.54, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpiperidin-4-yl)-1,3-diazinan-2-one is sourced from PubChem (CID 106996405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).