4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine

C20H18N2O — CID 13212029

IUPAC4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine
SMILESc1ccc(CN2CC(c3ccccc3)Oc3cccnc32)cc1
InChIInChI=1S/C20H18N2O/c1-3-8-16(9-4-1)14-22-15-19(17-10-5-2-6-11-17)23-18-12-7-13-21-20(18)22/h1-13,19H,14-15H2
InChIKeyOZYFPZQPMSQBNC-UHFFFAOYSA-N
MW302.38 g/mol
LogP4.22
Rot. Bonds3

About 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine

4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine (PubChem CID 13212029) has the molecular formula C20H18N2O and a molecular weight of 302.38 g/mol. Its IUPAC name is 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine.

Molecular Properties

Compound Name4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine
PubChem CID13212029
Molecular FormulaC20H18N2O
Molecular Weight302.38 g/mol
Exact Mass302.14
IUPAC Name4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine
SMILESc1ccc(CN2CC(c3ccccc3)Oc3cccnc32)cc1
InChIInChI=1S/C20H18N2O/c1-3-8-16(9-4-1)14-22-15-19(17-10-5-2-6-11-17)23-18-12-7-13-21-20(18)22/h1-13,19H,14-15H2
InChIKeyOZYFPZQPMSQBNC-UHFFFAOYSA-N
XLogP4.22
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine?
The IUPAC name of 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine (CID 13212029) is 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine.
What is the SMILES notation for 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine?
The canonical SMILES for 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine is c1ccc(CN2CC(c3ccccc3)Oc3cccnc32)cc1.
What is the InChIKey of 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine?
The InChIKey is OZYFPZQPMSQBNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O/c1-3-8-16(9-4-1)14-22-15-19(17-10-5-2-6-11-17)23-18-12-7-13-21-20(18)22/h1-13,19H,14-15H2.
What are the key properties of 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine?
4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine has a molecular weight of 302.38 g/mol, XLogP of 4.22, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-2-phenyl-2,3-dihydropyrido[3,2-b][1,4]oxazine is sourced from PubChem (CID 13212029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).