3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol

C15H12N2O2 — CID 55113006

IUPAC3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol
SMILESCc1nccc(Oc2cc3ccccc3cc2O)n1
InChIInChI=1S/C15H12N2O2/c1-10-16-7-6-15(17-10)19-14-9-12-5-3-2-4-11(12)8-13(14)18/h2-9,18H,1H3
InChIKeyUZFDTWGCWNKGFY-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.44
Rot. Bonds2

About 3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol

3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol (PubChem CID 55113006) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol.

Molecular Properties

Compound Name3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol
PubChem CID55113006
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol
SMILESCc1nccc(Oc2cc3ccccc3cc2O)n1
InChIInChI=1S/C15H12N2O2/c1-10-16-7-6-15(17-10)19-14-9-12-5-3-2-4-11(12)8-13(14)18/h2-9,18H,1H3
InChIKeyUZFDTWGCWNKGFY-UHFFFAOYSA-N
XLogP3.44
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-Hexyl-2-pyrimidin-2-yloxyphenol
CID 44450156
2-(7-Methoxynaphthalen-2-yl)oxypyrimidine
CID 2608253
N-ethyl-6-(2-methoxy-4-methylphenoxy)-N-methylpyrimidin-4-amine
CID 91633842
2-(2-Naphthyloxy)pyrimidine
CID 91415003
2-(3,4-Dimethoxystyryl)pyrimidine
CID 163359846
4-[4-Methyl-2-phenylmethoxy-3-(trifluoromethyl)phenoxy]pyrimidine
CID 67657199
2-Fluoro-6-octoxy-4-pyrimidin-2-ylphenol
CID 136486828
2,3-Difluoro-6-octoxy-4-pyrimidin-2-ylphenol
CID 136486834
2-Methyl-4-[2-[4-[4-methyl-3-(trifluoromethyl)phenoxy]phenyl]ethoxy]pyrimidine
CID 145184574
(e)-2-(3,4-Dimethoxystyryl)pyrimidine
CID 132581485
2-(3,4-Dimethylphenoxy)-4-(4-fluorophenoxy)pyrimidine
CID 56575506
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenoxy)-N-methylpyrimidin-2-amine
CID 56575808

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol?
The IUPAC name of 3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol (CID 55113006) is 3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol.
What is the SMILES notation for 3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol?
The canonical SMILES for 3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol is Cc1nccc(Oc2cc3ccccc3cc2O)n1.
What is the InChIKey of 3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol?
The InChIKey is UZFDTWGCWNKGFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-10-16-7-6-15(17-10)19-14-9-12-5-3-2-4-11(12)8-13(14)18/h2-9,18H,1H3.
What are the key properties of 3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol?
3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol has a molecular weight of 252.27 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpyrimidin-4-yl)oxynaphthalen-2-ol is sourced from PubChem (CID 55113006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).