2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol

C12H12N2O2 — CID 61224160

IUPAC2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol
SMILESCc1cc(Oc2cccc(O)c2C)ncn1
InChIInChI=1S/C12H12N2O2/c1-8-6-12(14-7-13-8)16-11-5-3-4-10(15)9(11)2/h3-7,15H,1-2H3
InChIKeyMPWKTDNGMBPAEX-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.59
Rot. Bonds2

About 2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol

2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol (PubChem CID 61224160) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol.

Molecular Properties

Compound Name2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol
PubChem CID61224160
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol
SMILESCc1cc(Oc2cccc(O)c2C)ncn1
InChIInChI=1S/C12H12N2O2/c1-8-6-12(14-7-13-8)16-11-5-3-4-10(15)9(11)2/h3-7,15H,1-2H3
InChIKeyMPWKTDNGMBPAEX-UHFFFAOYSA-N
XLogP2.59
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol?
The IUPAC name of 2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol (CID 61224160) is 2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol.
What is the SMILES notation for 2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol?
The canonical SMILES for 2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol is Cc1cc(Oc2cccc(O)c2C)ncn1.
What is the InChIKey of 2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol?
The InChIKey is MPWKTDNGMBPAEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-8-6-12(14-7-13-8)16-11-5-3-4-10(15)9(11)2/h3-7,15H,1-2H3.
What are the key properties of 2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol?
2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol has a molecular weight of 216.24 g/mol, XLogP of 2.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol is sourced from PubChem (CID 61224160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).