6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine

C9H15N3O3S — CID 66325409

IUPAC6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine
SMILESCOc1ncnc(NCCS(C)(=O)=O)c1C
InChIInChI=1S/C9H15N3O3S/c1-7-8(10-4-5-16(3,13)14)11-6-12-9(7)15-2/h6H,4-5H2,1-3H3,(H,10,11,12)
InChIKeyQTERSCZGFINSDH-UHFFFAOYSA-N
MW245.30 g/mol
LogP0.25
Rot. Bonds5

About 6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine

6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine (PubChem CID 66325409) has the molecular formula C9H15N3O3S and a molecular weight of 245.30 g/mol. Its IUPAC name is 6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine
PubChem CID66325409
Molecular FormulaC9H15N3O3S
Molecular Weight245.30 g/mol
Exact Mass245.08
IUPAC Name6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine
SMILESCOc1ncnc(NCCS(C)(=O)=O)c1C
InChIInChI=1S/C9H15N3O3S/c1-7-8(10-4-5-16(3,13)14)11-6-12-9(7)15-2/h6H,4-5H2,1-3H3,(H,10,11,12)
InChIKeyQTERSCZGFINSDH-UHFFFAOYSA-N
XLogP0.25
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]ethanesulfonamide
CID 106337998
6-methoxy-5-methyl-N-propylpyrimidin-4-amine
CID 66326211
N-ethyl-N-[3-[(6-methoxy-5-methylpyrimidin-4-yl)amino]propyl]methanesulfonamide
CID 66325411
N-(6-methoxy-5-methylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 66327244
N-hexyl-6-methoxy-5-methylpyrimidin-4-amine
CID 66325235
N-(2-but-3-enoxyethyl)-6-methoxy-5-methylpyrimidin-4-amine
CID 114184626
6-methoxy-5-methyl-N-(2-phenylethyl)pyrimidin-4-amine
CID 66327861
N-[2-(cyclopropylmethoxy)ethyl]-6-methoxy-5-methylpyrimidin-4-amine
CID 114098263
2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]acetamide
CID 66327451
6-methoxy-5-methyl-N-(3-propoxypropyl)pyrimidin-4-amine
CID 82943748
N-cyclopropyl-N'-(6-methoxy-5-methylpyrimidin-4-yl)propane-1,3-diamine
CID 66332349
5-[(6-methoxy-5-methylpyrimidin-4-yl)amino]-2-methylpentan-1-ol
CID 106162116

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine?
The IUPAC name of 6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine (CID 66325409) is 6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine is COc1ncnc(NCCS(C)(=O)=O)c1C.
What is the InChIKey of 6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine?
The InChIKey is QTERSCZGFINSDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3S/c1-7-8(10-4-5-16(3,13)14)11-6-12-9(7)15-2/h6H,4-5H2,1-3H3,(H,10,11,12).
What are the key properties of 6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine?
6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine has a molecular weight of 245.30 g/mol, XLogP of 0.25, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5-methyl-N-(2-methylsulfonylethyl)pyrimidin-4-amine is sourced from PubChem (CID 66325409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).