4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine

C15H11ClN2O — CID 62482714

IUPAC4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine
SMILESCc1nc(Cl)cc(Oc2cccc3ccccc23)n1
InChIInChI=1S/C15H11ClN2O/c1-10-17-14(16)9-15(18-10)19-13-8-4-6-11-5-2-3-7-12(11)13/h2-9H,1H3
InChIKeyZIMHTJPPQKNKPB-UHFFFAOYSA-N
MW270.72 g/mol
LogP4.38
Rot. Bonds2

About 4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine

4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine (PubChem CID 62482714) has the molecular formula C15H11ClN2O and a molecular weight of 270.72 g/mol. Its IUPAC name is 4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine.

Molecular Properties

Compound Name4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine
PubChem CID62482714
Molecular FormulaC15H11ClN2O
Molecular Weight270.72 g/mol
Exact Mass270.06
IUPAC Name4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine
SMILESCc1nc(Cl)cc(Oc2cccc3ccccc23)n1
InChIInChI=1S/C15H11ClN2O/c1-10-17-14(16)9-15(18-10)19-13-8-4-6-11-5-2-3-7-12(11)13/h2-9H,1H3
InChIKeyZIMHTJPPQKNKPB-UHFFFAOYSA-N
XLogP4.38
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine?
The IUPAC name of 4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine (CID 62482714) is 4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine.
What is the SMILES notation for 4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine?
The canonical SMILES for 4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine is Cc1nc(Cl)cc(Oc2cccc3ccccc23)n1.
What is the InChIKey of 4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine?
The InChIKey is ZIMHTJPPQKNKPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O/c1-10-17-14(16)9-15(18-10)19-13-8-4-6-11-5-2-3-7-12(11)13/h2-9H,1H3.
What are the key properties of 4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine?
4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine has a molecular weight of 270.72 g/mol, XLogP of 4.38, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methyl-6-naphthalen-1-yloxypyrimidine is sourced from PubChem (CID 62482714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).