2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine

C19H13N3O — CID 167050184

IUPAC2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine
SMILESc1ccc(-c2ccccc2Oc2ncc3cnccc3n2)cc1
InChIInChI=1S/C19H13N3O/c1-2-6-14(7-3-1)16-8-4-5-9-18(16)23-19-21-13-15-12-20-11-10-17(15)22-19/h1-13H
InChIKeyMRXYLLKYFBCGHD-UHFFFAOYSA-N
MW299.33 g/mol
LogP4.48
Rot. Bonds3

About 2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine

2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine (PubChem CID 167050184) has the molecular formula C19H13N3O and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine.

Molecular Properties

Compound Name2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine
PubChem CID167050184
Molecular FormulaC19H13N3O
Molecular Weight299.33 g/mol
Exact Mass299.11
IUPAC Name2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine
SMILESc1ccc(-c2ccccc2Oc2ncc3cnccc3n2)cc1
InChIInChI=1S/C19H13N3O/c1-2-6-14(7-3-1)16-8-4-5-9-18(16)23-19-21-13-15-12-20-11-10-17(15)22-19/h1-13H
InChIKeyMRXYLLKYFBCGHD-UHFFFAOYSA-N
XLogP4.48
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine?
The IUPAC name of 2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine (CID 167050184) is 2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine.
What is the SMILES notation for 2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine?
The canonical SMILES for 2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine is c1ccc(-c2ccccc2Oc2ncc3cnccc3n2)cc1.
What is the InChIKey of 2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine?
The InChIKey is MRXYLLKYFBCGHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3O/c1-2-6-14(7-3-1)16-8-4-5-9-18(16)23-19-21-13-15-12-20-11-10-17(15)22-19/h1-13H.
What are the key properties of 2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine?
2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine has a molecular weight of 299.33 g/mol, XLogP of 4.48, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylphenoxy)pyrido[4,3-d]pyrimidine is sourced from PubChem (CID 167050184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).