6-methoxy-4-phenoxycinnoline

C15H12N2O2 — CID 134868341

IUPAC6-methoxy-4-phenoxycinnoline
SMILESCOc1ccc2nncc(Oc3ccccc3)c2c1
InChIInChI=1S/C15H12N2O2/c1-18-12-7-8-14-13(9-12)15(10-16-17-14)19-11-5-3-2-4-6-11/h2-10H,1H3
InChIKeyUOKDSLHJBXKGJW-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.43
Rot. Bonds3

About 6-methoxy-4-phenoxycinnoline

6-methoxy-4-phenoxycinnoline (PubChem CID 134868341) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 6-methoxy-4-phenoxycinnoline.

Molecular Properties

Compound Name6-methoxy-4-phenoxycinnoline
PubChem CID134868341
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name6-methoxy-4-phenoxycinnoline
SMILESCOc1ccc2nncc(Oc3ccccc3)c2c1
InChIInChI=1S/C15H12N2O2/c1-18-12-7-8-14-13(9-12)15(10-16-17-14)19-11-5-3-2-4-6-11/h2-10H,1H3
InChIKeyUOKDSLHJBXKGJW-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 6-methoxy-4-phenoxycinnoline?
The IUPAC name of 6-methoxy-4-phenoxycinnoline (CID 134868341) is 6-methoxy-4-phenoxycinnoline.
What is the SMILES notation for 6-methoxy-4-phenoxycinnoline?
The canonical SMILES for 6-methoxy-4-phenoxycinnoline is COc1ccc2nncc(Oc3ccccc3)c2c1.
What is the InChIKey of 6-methoxy-4-phenoxycinnoline?
The InChIKey is UOKDSLHJBXKGJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-18-12-7-8-14-13(9-12)15(10-16-17-14)19-11-5-3-2-4-6-11/h2-10H,1H3.
What are the key properties of 6-methoxy-4-phenoxycinnoline?
6-methoxy-4-phenoxycinnoline 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 6-methoxy-4-phenoxycinnoline is sourced from PubChem (CID 134868341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).