2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one

C9H13N3O2 — CID 135592113

IUPAC2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one
SMILESCc1nc(N2CCOCC2)cc(=O)[nH]1
InChIInChI=1S/C9H13N3O2/c1-7-10-8(6-9(13)11-7)12-2-4-14-5-3-12/h6H,2-5H2,1H3,(H,10,11,13)
InChIKeyHVUNVDNLCOIYBA-UHFFFAOYSA-N
MW195.22 g/mol
LogP-0.09
Rot. Bonds1

About 2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one

2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one (PubChem CID 135592113) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one
PubChem CID135592113
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one
SMILESCc1nc(N2CCOCC2)cc(=O)[nH]1
InChIInChI=1S/C9H13N3O2/c1-7-10-8(6-9(13)11-7)12-2-4-14-5-3-12/h6H,2-5H2,1H3,(H,10,11,13)
InChIKeyHVUNVDNLCOIYBA-UHFFFAOYSA-N
XLogP-0.09
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-4-morpholin-4-yl-1H-pyrimidin-6-one
CID 137130492
2-methyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-6-one
CID 136957952
2-methyl-4-(4-propylpiperazin-1-yl)-1H-pyrimidin-6-one
CID 136957344
2-methyl-4-[2-(methylaminomethyl)morpholin-4-yl]-1H-pyrimidin-6-one
CID 136978852
2-methyl-4-(2-methyl-1,4-oxazepan-4-yl)-1H-pyrimidin-6-one
CID 136957833
2-methyl-4-[(3S)-3-methylpiperazin-1-yl]-1H-pyrimidin-6-one
CID 136842971
4-[3-(aminomethyl)morpholin-4-yl]-2-methyl-1H-pyrimidin-6-one
CID 137008164
4-methyl-1-(2-methyl-6-oxo-1H-pyrimidin-4-yl)piperidine-4-carboxylic acid
CID 137015803
2-[4-(2-methyl-6-oxo-1H-pyrimidin-4-yl)piperazin-1-yl]propanenitrile
CID 136973037
2-[4-(2-methyl-6-oxo-1H-pyrimidin-4-yl)piperazin-1-yl]ethanethioamide
CID 136973219
4-[3-(dimethylamino)pyrrolidin-1-yl]-2-methyl-1H-pyrimidin-6-one
CID 136957825
4-[4-(5-aminopentyl)piperazin-1-yl]-2-methyl-1H-pyrimidin-6-one
CID 136972676

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one?
The IUPAC name of 2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one (CID 135592113) is 2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one?
The canonical SMILES for 2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one is Cc1nc(N2CCOCC2)cc(=O)[nH]1.
What is the InChIKey of 2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one?
The InChIKey is HVUNVDNLCOIYBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-7-10-8(6-9(13)11-7)12-2-4-14-5-3-12/h6H,2-5H2,1H3,(H,10,11,13).
What are the key properties of 2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one?
2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one has a molecular weight of 195.22 g/mol, XLogP of -0.09, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 135592113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).