2-naphthalen-2-yloxypyrimidine

C14H10N2O — CID 91415003

IUPAC2-naphthalen-2-yloxypyrimidine
SMILESc1cnc(Oc2ccc3ccccc3c2)nc1
InChIInChI=1S/C14H10N2O/c1-2-5-12-10-13(7-6-11(12)4-1)17-14-15-8-3-9-16-14/h1-10H
InChIKeyDEMMZLVESXVKJF-UHFFFAOYSA-N
MW222.25 g/mol
LogP3.42
Rot. Bonds2

About 2-naphthalen-2-yloxypyrimidine

2-naphthalen-2-yloxypyrimidine (PubChem CID 91415003) has the molecular formula C14H10N2O and a molecular weight of 222.25 g/mol. Its IUPAC name is 2-naphthalen-2-yloxypyrimidine.

Molecular Properties

Compound Name2-naphthalen-2-yloxypyrimidine
PubChem CID91415003
Molecular FormulaC14H10N2O
Molecular Weight222.25 g/mol
Exact Mass222.08
IUPAC Name2-naphthalen-2-yloxypyrimidine
SMILESc1cnc(Oc2ccc3ccccc3c2)nc1
InChIInChI=1S/C14H10N2O/c1-2-5-12-10-13(7-6-11(12)4-1)17-14-15-8-3-9-16-14/h1-10H
InChIKeyDEMMZLVESXVKJF-UHFFFAOYSA-N
XLogP3.42
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxypyrimidine?
The IUPAC name of 2-naphthalen-2-yloxypyrimidine (CID 91415003) is 2-naphthalen-2-yloxypyrimidine.
What is the SMILES notation for 2-naphthalen-2-yloxypyrimidine?
The canonical SMILES for 2-naphthalen-2-yloxypyrimidine is c1cnc(Oc2ccc3ccccc3c2)nc1.
What is the InChIKey of 2-naphthalen-2-yloxypyrimidine?
The InChIKey is DEMMZLVESXVKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O/c1-2-5-12-10-13(7-6-11(12)4-1)17-14-15-8-3-9-16-14/h1-10H.
What are the key properties of 2-naphthalen-2-yloxypyrimidine?
2-naphthalen-2-yloxypyrimidine has a molecular weight of 222.25 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxypyrimidine is sourced from PubChem (CID 91415003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).