4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one

C12H19N3O2 — CID 136822016

IUPAC4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
SMILESCC1(C)CN(c2cc(=O)[nH]cn2)CC(C)(C)O1
InChIInChI=1S/C12H19N3O2/c1-11(2)6-15(7-12(3,4)17-11)9-5-10(16)14-8-13-9/h5,8H,6-7H2,1-4H3,(H,13,14,16)
InChIKeySWDGOJABNVSIHW-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.16
Rot. Bonds1

About 4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one

4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one (PubChem CID 136822016) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
PubChem CID136822016
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
SMILESCC1(C)CN(c2cc(=O)[nH]cn2)CC(C)(C)O1
InChIInChI=1S/C12H19N3O2/c1-11(2)6-15(7-12(3,4)17-11)9-5-10(16)14-8-13-9/h5,8H,6-7H2,1-4H3,(H,13,14,16)
InChIKeySWDGOJABNVSIHW-UHFFFAOYSA-N
XLogP1.16
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-Morpholinopyrimidin-4-ol
CID 136128233
4-[2-(fluoromethyl)morpholin-4-yl]-1H-pyrimidin-6-one
CID 157738230
4-(3,3-dideuteriomorpholin-4-yl)-1H-pyrimidin-6-one
CID 137138532
2-(Ethylamino)-6-morpholin-4-yl-3-propylpyrimidin-4-one
CID 160654602
4-(3-methoxy-3-methylpiperidin-1-yl)-1H-pyrimidin-6-one
CID 136716215
4-[2-(aminomethyl)-6-methylmorpholin-4-yl]-1H-pyrimidin-6-one
CID 136783270
5-bromo-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
CID 136792833
5-chloro-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
CID 136792834
2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
CID 136822012
5-amino-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
CID 136822013
5-methoxy-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
CID 136822015
2-ethyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one
CID 136822017

Frequently Asked Questions

What is the IUPAC name of 4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one?
The IUPAC name of 4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one (CID 136822016) is 4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one?
The canonical SMILES for 4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one is CC1(C)CN(c2cc(=O)[nH]cn2)CC(C)(C)O1.
What is the InChIKey of 4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one?
The InChIKey is SWDGOJABNVSIHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-11(2)6-15(7-12(3,4)17-11)9-5-10(16)14-8-13-9/h5,8H,6-7H2,1-4H3,(H,13,14,16).
What are the key properties of 4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one?
4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one has a molecular weight of 237.30 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2,6,6-tetramethylmorpholin-4-yl)-1H-pyrimidin-6-one is sourced from PubChem (CID 136822016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).