6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine

C14H18N4OS — CID 103176374

IUPAC6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine
SMILESCCc1nc(C)ccc1Oc1cc(NC)nc(SC)n1
InChIInChI=1S/C14H18N4OS/c1-5-10-11(7-6-9(2)16-10)19-13-8-12(15-3)17-14(18-13)20-4/h6-8H,5H2,1-4H3,(H,15,17,18)
InChIKeyOZAFSEDCOLRDQP-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.30
Rot. Bonds5

About 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine

6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine (PubChem CID 103176374) has the molecular formula C14H18N4OS and a molecular weight of 290.39 g/mol. Its IUPAC name is 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine
PubChem CID103176374
Molecular FormulaC14H18N4OS
Molecular Weight290.39 g/mol
Exact Mass290.12
IUPAC Name6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine
SMILESCCc1nc(C)ccc1Oc1cc(NC)nc(SC)n1
InChIInChI=1S/C14H18N4OS/c1-5-10-11(7-6-9(2)16-10)19-13-8-12(15-3)17-14(18-13)20-4/h6-8H,5H2,1-4H3,(H,15,17,18)
InChIKeyOZAFSEDCOLRDQP-UHFFFAOYSA-N
XLogP3.30
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(2-fluoro-3-methylphenoxy)-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 107662702
N-ethyl-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine
CID 103176355
6-(2-iodophenoxy)-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 80875276
6-(3,4-dimethylphenoxy)-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 80864389
4-N-ethyl-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine
CID 103176372
6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyrimidine-2,4-diamine
CID 103176389
[4-[6-(methylamino)-2-methylsulfanylpyrimidin-4-yl]oxyphenyl]methanol
CID 80871561
N-ethyl-6-(5-fluoro-2-methylphenoxy)-2-methylsulfanylpyrimidin-4-amine
CID 102989125
6-(4-chloro-2,6-dimethylphenoxy)-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 80863333
1-[2-ethyl-6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-4-pyridinyl]-N-methylmethanamine
CID 103175494
6-(2-chloro-4-nitrophenoxy)-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 80878734
[6-(2-ethylphenoxy)-2-methylsulfanylpyrimidin-4-yl]hydrazine
CID 80916805

Frequently Asked Questions

What is the IUPAC name of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine?
The IUPAC name of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine (CID 103176374) is 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine.
What is the SMILES notation for 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine?
The canonical SMILES for 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine is CCc1nc(C)ccc1Oc1cc(NC)nc(SC)n1.
What is the InChIKey of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine?
The InChIKey is OZAFSEDCOLRDQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4OS/c1-5-10-11(7-6-9(2)16-10)19-13-8-12(15-3)17-14(18-13)20-4/h6-8H,5H2,1-4H3,(H,15,17,18).
What are the key properties of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine?
6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine has a molecular weight of 290.39 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine is sourced from PubChem (CID 103176374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).