2-(7-methoxynaphthalen-2-yl)oxypyrimidine

C15H12N2O2 — CID 2608253

IUPAC2-(7-methoxynaphthalen-2-yl)oxypyrimidine
SMILESCOc1ccc2ccc(Oc3ncccn3)cc2c1
InChIInChI=1S/C15H12N2O2/c1-18-13-5-3-11-4-6-14(10-12(11)9-13)19-15-16-7-2-8-17-15/h2-10H,1H3
InChIKeyXLVFDCPGZBYSDO-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.43
Rot. Bonds3

About 2-(7-methoxynaphthalen-2-yl)oxypyrimidine

2-(7-methoxynaphthalen-2-yl)oxypyrimidine (PubChem CID 2608253) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 2-(7-methoxynaphthalen-2-yl)oxypyrimidine.

Molecular Properties

Compound Name2-(7-methoxynaphthalen-2-yl)oxypyrimidine
PubChem CID2608253
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name2-(7-methoxynaphthalen-2-yl)oxypyrimidine
SMILESCOc1ccc2ccc(Oc3ncccn3)cc2c1
InChIInChI=1S/C15H12N2O2/c1-18-13-5-3-11-4-6-14(10-12(11)9-13)19-15-16-7-2-8-17-15/h2-10H,1H3
InChIKeyXLVFDCPGZBYSDO-UHFFFAOYSA-N
XLogP3.43
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxynaphthalen-2-yl)oxypyrimidine?
The IUPAC name of 2-(7-methoxynaphthalen-2-yl)oxypyrimidine (CID 2608253) is 2-(7-methoxynaphthalen-2-yl)oxypyrimidine.
What is the SMILES notation for 2-(7-methoxynaphthalen-2-yl)oxypyrimidine?
The canonical SMILES for 2-(7-methoxynaphthalen-2-yl)oxypyrimidine is COc1ccc2ccc(Oc3ncccn3)cc2c1.
What is the InChIKey of 2-(7-methoxynaphthalen-2-yl)oxypyrimidine?
The InChIKey is XLVFDCPGZBYSDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-18-13-5-3-11-4-6-14(10-12(11)9-13)19-15-16-7-2-8-17-15/h2-10H,1H3.
What are the key properties of 2-(7-methoxynaphthalen-2-yl)oxypyrimidine?
2-(7-methoxynaphthalen-2-yl)oxypyrimidine has a molecular weight of 252.27 g/mol, XLogP of 3.43, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxynaphthalen-2-yl)oxypyrimidine is sourced from PubChem (CID 2608253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).