1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one

C12H23N3O — CID 125041151

IUPAC1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one
SMILESCC(C)N1CCCN([C@@H]2CCCNC2)C1=O
InChIInChI=1S/C12H23N3O/c1-10(2)14-7-4-8-15(12(14)16)11-5-3-6-13-9-11/h10-11,13H,3-9H2,1-2H3/t11-/m1/s1
InChIKeyDASDTWPLCYZOSL-LLVKDONJSA-N
MW225.34 g/mol
LogP1.27
Rot. Bonds2

About 1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one

1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one (PubChem CID 125041151) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one.

Molecular Properties

Compound Name1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one
PubChem CID125041151
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one
SMILESCC(C)N1CCCN([C@@H]2CCCNC2)C1=O
InChIInChI=1S/C12H23N3O/c1-10(2)14-7-4-8-15(12(14)16)11-5-3-6-13-9-11/h10-11,13H,3-9H2,1-2H3/t11-/m1/s1
InChIKeyDASDTWPLCYZOSL-LLVKDONJSA-N
XLogP1.27
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-3-[(3R)-piperidin-3-yl]-1,3-diazinan-2-one;hydrochloride
CID 118115291
1-(1-phenylethyl)-3-[(3S)-piperidin-3-yl]imidazolidin-2-one
CID 138622014
1-cyclopropyl-3-piperidin-3-ylimidazolidin-2-one;hydrochloride
CID 118115296
1-methyl-3-piperidin-3-ylimidazolidin-2-one;trihydrochloride
CID 175684354
1-[(3R)-piperidin-3-yl]-1,3-diazinan-2-one;hydrochloride
CID 162422983
1,3-di(propan-2-yl)-1,3-diazinan-2-one;ethane
CID 157428700
3,3-dimethyl-1-[(3R)-piperidin-3-yl]azetidin-2-one
CID 129450905
1-piperidin-3-yl-1,3-diazinane-2,4-dione
CID 75607085
1-methyl-3-[(3S)-pyrrolidin-3-yl]imidazolidin-2-one
CID 96631898
3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride
CID 167727849
1-(3-chlorophenyl)-3-[(3R)-piperidin-3-yl]imidazolidin-2-one
CID 118115135
1-piperidin-3-yl-4-(1H-pyrrol-2-yl)imidazolidin-2-one
CID 116979012

Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one?
The IUPAC name of 1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one (CID 125041151) is 1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one.
What is the SMILES notation for 1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one?
The canonical SMILES for 1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one is CC(C)N1CCCN([C@@H]2CCCNC2)C1=O.
What is the InChIKey of 1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one?
The InChIKey is DASDTWPLCYZOSL-LLVKDONJSA-N. The full InChI is InChI=1S/C12H23N3O/c1-10(2)14-7-4-8-15(12(14)16)11-5-3-6-13-9-11/h10-11,13H,3-9H2,1-2H3/t11-/m1/s1.
What are the key properties of 1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one?
1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one has a molecular weight of 225.34 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-piperidin-3-yl]-3-propan-2-yl-1,3-diazinan-2-one is sourced from PubChem (CID 125041151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).