5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine

C16H13N3O — CID 162507638

IUPAC5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine
SMILESCc1cc(-c2cnc(Oc3ccccc3)nc2)ccn1
InChIInChI=1S/C16H13N3O/c1-12-9-13(7-8-17-12)14-10-18-16(19-11-14)20-15-5-3-2-4-6-15/h2-11H,1H3
InChIKeyBIVYFKGLQMXHMV-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.64
Rot. Bonds3

About 5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine

5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine (PubChem CID 162507638) has the molecular formula C16H13N3O and a molecular weight of 263.30 g/mol. Its IUPAC name is 5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine.

Molecular Properties

Compound Name5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine
PubChem CID162507638
Molecular FormulaC16H13N3O
Molecular Weight263.30 g/mol
Exact Mass263.11
IUPAC Name5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine
SMILESCc1cc(-c2cnc(Oc3ccccc3)nc2)ccn1
InChIInChI=1S/C16H13N3O/c1-12-9-13(7-8-17-12)14-10-18-16(19-11-14)20-15-5-3-2-4-6-15/h2-11H,1H3
InChIKeyBIVYFKGLQMXHMV-UHFFFAOYSA-N
XLogP3.64
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

iodomethane;2-methyl-4-phenylpyridine
CID 143719183
5-(6-methoxy-3-pyridinyl)-2-phenoxypyrimidine
CID 146597513
1-methyl-5-(2-phenoxypyrimidin-5-yl)indole
CID 162507455
2-phenoxy-5-[2-(trifluoromethyl)pyrimidin-5-yl]pyrimidine
CID 162507482
ethane;2-methyl-4-(1-methylpyridin-1-ium-2-yl)pyridine
CID 155692728
2-methyl-4-pyridin-3-ylpyridine;propane
CID 144569163
5-(5-methyl-2-pyridin-3-yl-1H-imidazol-4-yl)-2-phenoxypyrimidine
CID 67360379
2-methyl-4-[5-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]-3-pyridinyl]pyridine
CID 88554596
N-(3-methoxypropyl)-3-(2-phenoxypyrimidin-5-yl)benzamide
CID 53116963
5-(2-phenoxypyrimidin-5-yl)-1H-pyrazol-4-amine
CID 151009630
6-methoxy-9-(2-methyl-4-pyridinyl)-1H-diazonine
CID 123778324
4-(2,6-dimethylphenyl)-2-methylpyridine
CID 126725908

Frequently Asked Questions

What is the IUPAC name of 5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine?
The IUPAC name of 5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine (CID 162507638) is 5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine.
What is the SMILES notation for 5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine?
The canonical SMILES for 5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine is Cc1cc(-c2cnc(Oc3ccccc3)nc2)ccn1.
What is the InChIKey of 5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine?
The InChIKey is BIVYFKGLQMXHMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O/c1-12-9-13(7-8-17-12)14-10-18-16(19-11-14)20-15-5-3-2-4-6-15/h2-11H,1H3.
What are the key properties of 5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine?
5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine has a molecular weight of 263.30 g/mol, XLogP of 3.64, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methyl-4-pyridinyl)-2-phenoxypyrimidine is sourced from PubChem (CID 162507638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).