2-(3-methylphenoxy)pyrimidine

C11H10N2O — CID 20603792

IUPAC2-(3-methylphenoxy)pyrimidine
SMILESCc1cccc(Oc2ncccn2)c1
InChIInChI=1S/C11H10N2O/c1-9-4-2-5-10(8-9)14-11-12-6-3-7-13-11/h2-8H,1H3
InChIKeyKRYXUBOKEORYMR-UHFFFAOYSA-N
MW186.21 g/mol
LogP2.58
Rot. Bonds2

About 2-(3-methylphenoxy)pyrimidine

2-(3-methylphenoxy)pyrimidine (PubChem CID 20603792) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-(3-methylphenoxy)pyrimidine.

Molecular Properties

Compound Name2-(3-methylphenoxy)pyrimidine
PubChem CID20603792
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name2-(3-methylphenoxy)pyrimidine
SMILESCc1cccc(Oc2ncccn2)c1
InChIInChI=1S/C11H10N2O/c1-9-4-2-5-10(8-9)14-11-12-6-3-7-13-11/h2-8H,1H3
InChIKeyKRYXUBOKEORYMR-UHFFFAOYSA-N
XLogP2.58
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dimethoxy-6-(3-methylphenoxy)-1,3,5-triazine
CID 121014438
3-methyl-5-pyrimidin-2-yloxyphenol
CID 107680712
4-(3-methylphenoxy)quinoline
CID 12798303
1-methyl-3-phenoxybenzene;hydrochloride
CID 175116002
5-fluoro-2,4-bis(3-methylphenoxy)pyrimidine
CID 679767
1-methyl-2-(3-methylphenoxy)imidazole
CID 117189440
1-methyl-3-[4-[4-(3-methylphenoxy)phenyl]phenoxy]benzene
CID 22967305
4-methoxy-6-(3-methylphenoxy)-1,3,5-triazin-2-amine
CID 80869241
1-chloro-4-(3-methylphenoxy)benzene;yttrium
CID 159299201
1,2,3-tris(3-methylphenoxy)benzene
CID 139940681
[4-[3-(3-methylphenoxy)pyrazin-2-yl]piperidin-1-yl]-(3-pyrimidin-2-yloxyphenyl)methanone
CID 129458305
2-methyl-4-pyrimidin-2-yloxybenzonitrile
CID 70098326

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)pyrimidine?
The IUPAC name of 2-(3-methylphenoxy)pyrimidine (CID 20603792) is 2-(3-methylphenoxy)pyrimidine.
What is the SMILES notation for 2-(3-methylphenoxy)pyrimidine?
The canonical SMILES for 2-(3-methylphenoxy)pyrimidine is Cc1cccc(Oc2ncccn2)c1.
What is the InChIKey of 2-(3-methylphenoxy)pyrimidine?
The InChIKey is KRYXUBOKEORYMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c1-9-4-2-5-10(8-9)14-11-12-6-3-7-13-11/h2-8H,1H3.
What are the key properties of 2-(3-methylphenoxy)pyrimidine?
2-(3-methylphenoxy)pyrimidine has a molecular weight of 186.21 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)pyrimidine is sourced from PubChem (CID 20603792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).