6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine

C14H18N4O2 — CID 103176379

IUPAC6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine
SMILESCCc1nc(C)ccc1Oc1ncnc(NC)c1OC
InChIInChI=1S/C14H18N4O2/c1-5-10-11(7-6-9(2)18-10)20-14-12(19-4)13(15-3)16-8-17-14/h6-8H,5H2,1-4H3,(H,15,16,17)
InChIKeyFHVUXQRLFMNUNF-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.59
Rot. Bonds5

About 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine

6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine (PubChem CID 103176379) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine
PubChem CID103176379
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine
SMILESCCc1nc(C)ccc1Oc1ncnc(NC)c1OC
InChIInChI=1S/C14H18N4O2/c1-5-10-11(7-6-9(2)18-10)20-14-12(19-4)13(15-3)16-8-17-14/h6-8H,5H2,1-4H3,(H,15,16,17)
InChIKeyFHVUXQRLFMNUNF-UHFFFAOYSA-N
XLogP2.59
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine?
The IUPAC name of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine (CID 103176379) is 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine is CCc1nc(C)ccc1Oc1ncnc(NC)c1OC.
What is the InChIKey of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine?
The InChIKey is FHVUXQRLFMNUNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-5-10-11(7-6-9(2)18-10)20-14-12(19-4)13(15-3)16-8-17-14/h6-8H,5H2,1-4H3,(H,15,16,17).
What are the key properties of 6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine?
6-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-5-methoxy-N-methylpyrimidin-4-amine has a molecular weight of 274.32 g/mol, XLogP of 2.59, 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]-5-methoxy-N-methylpyrimidin-4-amine is sourced from PubChem (CID 103176379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).