3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione

C9H13N3O3 — CID 3254441

IUPAC3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione
SMILESCn1c(=O)cc(N2CCOCC2)[nH]c1=O
InChIInChI=1S/C9H13N3O3/c1-11-8(13)6-7(10-9(11)14)12-2-4-15-5-3-12/h6H,2-5H2,1H3,(H,10,14)
InChIKeyIMNCZQBLOHIUTI-UHFFFAOYSA-N
MW211.22 g/mol
LogP-1.09
Rot. Bonds1

About 3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione

3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione (PubChem CID 3254441) has the molecular formula C9H13N3O3 and a molecular weight of 211.22 g/mol. Its IUPAC name is 3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione
PubChem CID3254441
Molecular FormulaC9H13N3O3
Molecular Weight211.22 g/mol
Exact Mass211.10
IUPAC Name3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione
SMILESCn1c(=O)cc(N2CCOCC2)[nH]c1=O
InChIInChI=1S/C9H13N3O3/c1-11-8(13)6-7(10-9(11)14)12-2-4-15-5-3-12/h6H,2-5H2,1H3,(H,10,14)
InChIKeyIMNCZQBLOHIUTI-UHFFFAOYSA-N
XLogP-1.09
TPSA67.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 5-1.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1,3-dimethyl-6-morpholino-2,4(1H,3H)-pyrimidinedione
CID 2801167
6-Amino-1-(2-methoxyethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 1644232
3-butyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione
CID 5310386
3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione
CID 4141055
3-(Morpholin-4-ylmethyl)-1,3-dihydropyrimidine-2,4-dione
CID 260818
6-morpholin-4-yl-3-propan-2-yl-1H-pyrimidine-2,4-dione
CID 134987665
1-(2-Morpholin-4-yl-2-oxoethyl)pyrimidine-2,4-dione
CID 299310
6-(4-morpholinylmethyl)-2,4(1H,3H)-pyrimidinedione
CID 1811318
3-Methyl-6-morpholin-4-yl-1-prop-2-enylpyrimidine-2,4-dione
CID 4113671
3-Methyl-6-(3-morpholin-4-ylpropylamino)-1-prop-2-enylpyrimidine-2,4-dione
CID 4345306
6-(2,6-dimethylmorpholin-4-yl)-3-methyl-1H-pyrimidine-2,4-dione
CID 5233563
6-morpholinopyrimidine-2,4(1H,3H)-dione
CID 12181192

Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione?
The IUPAC name of 3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione (CID 3254441) is 3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione is Cn1c(=O)cc(N2CCOCC2)[nH]c1=O.
What is the InChIKey of 3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione?
The InChIKey is IMNCZQBLOHIUTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3/c1-11-8(13)6-7(10-9(11)14)12-2-4-15-5-3-12/h6H,2-5H2,1H3,(H,10,14).
What are the key properties of 3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione?
3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione has a molecular weight of 211.22 g/mol, XLogP of -1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 3254441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).