5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione

C10H15N3OS — CID 106476655

IUPAC5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione
SMILESCc1[nH]c(N2CCOCC2)nc(=S)c1C
InChIInChI=1S/C10H15N3OS/c1-7-8(2)11-10(12-9(7)15)13-3-5-14-6-4-13/h3-6H2,1-2H3,(H,11,12,15)
InChIKeyODDFYFCJKMODJZ-UHFFFAOYSA-N
MW225.32 g/mol
LogP1.59
Rot. Bonds1

About 5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione

5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione (PubChem CID 106476655) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione.

Molecular Properties

Compound Name5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione
PubChem CID106476655
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione
SMILESCc1[nH]c(N2CCOCC2)nc(=S)c1C
InChIInChI=1S/C10H15N3OS/c1-7-8(2)11-10(12-9(7)15)13-3-5-14-6-4-13/h3-6H2,1-2H3,(H,11,12,15)
InChIKeyODDFYFCJKMODJZ-UHFFFAOYSA-N
XLogP1.59
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Related Compounds

5-Amino-6-methyl-2-morpholino-4-pyrimidinethiol
CID 129855545
5-amino-2-methyl-6-morpholin-4-yl-1H-pyrimidine-4-thione
CID 20085301
6-methyl-2-morpholin-4-yl-1H-pyrimidine-4-thione
CID 17606458
5-ethyl-6-methyl-2-morpholin-4-yl-1H-pyrimidine-4-thione
CID 106476897
6-ethyl-5-methyl-2-morpholin-4-yl-1H-pyrimidine-4-thione
CID 106478155
5-bromo-6-methyl-2-morpholin-4-yl-1H-pyrimidine-4-thione
CID 106479056
2-morpholin-4-yl-5,7-dihydro-1H-thieno[3,4-d]pyrimidine-4-thione
CID 106481608
6-methyl-2-morpholin-4-yl-5-propan-2-yl-1H-pyrimidine-4-thione
CID 113839309

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione?
The IUPAC name of 5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione (CID 106476655) is 5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione.
What is the SMILES notation for 5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione?
The canonical SMILES for 5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione is Cc1[nH]c(N2CCOCC2)nc(=S)c1C.
What is the InChIKey of 5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione?
The InChIKey is ODDFYFCJKMODJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-7-8(2)11-10(12-9(7)15)13-3-5-14-6-4-13/h3-6H2,1-2H3,(H,11,12,15).
What are the key properties of 5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione?
5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione has a molecular weight of 225.32 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-2-morpholin-4-yl-1H-pyrimidine-4-thione is sourced from PubChem (CID 106476655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).