2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine

C16H18N2O — CID 13212019

IUPAC2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine
SMILESCC1CN(C(C)c2ccccc2)c2ncccc2O1
InChIInChI=1S/C16H18N2O/c1-12-11-18(13(2)14-7-4-3-5-8-14)16-15(19-12)9-6-10-17-16/h3-10,12-13H,11H2,1-2H3
InChIKeyVBGNGHGLNVQOBJ-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.43
Rot. Bonds2

About 2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine

2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine (PubChem CID 13212019) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine.

Molecular Properties

Compound Name2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine
PubChem CID13212019
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine
SMILESCC1CN(C(C)c2ccccc2)c2ncccc2O1
InChIInChI=1S/C16H18N2O/c1-12-11-18(13(2)14-7-4-3-5-8-14)16-15(19-12)9-6-10-17-16/h3-10,12-13H,11H2,1-2H3
InChIKeyVBGNGHGLNVQOBJ-UHFFFAOYSA-N
XLogP3.43
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-methyl-4-(1-phenylethyl)-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

Related Compounds

CID 90334
CID 90334
CID 5041
CID 5041
CID 51003564
CID 51003564
CID 5615
CID 5615
CID 3663276
CID 3663276
CID 11321863
CID 11321863
CID 71627414
CID 71627414
CID 9880373
CID 9880373
CID 46209194
CID 46209194
CID 4421960
CID 4421960
CID 54592009
CID 54592009
CID 46207731
CID 46207731

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine?
The IUPAC name of 2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine (CID 13212019) is 2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine.
What is the SMILES notation for 2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine?
The canonical SMILES for 2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine is CC1CN(C(C)c2ccccc2)c2ncccc2O1.
What is the InChIKey of 2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine?
The InChIKey is VBGNGHGLNVQOBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-12-11-18(13(2)14-7-4-3-5-8-14)16-15(19-12)9-6-10-17-16/h3-10,12-13H,11H2,1-2H3.
What are the key properties of 2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine?
2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine has a molecular weight of 254.33 g/mol, XLogP of 3.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(1-phenylethyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine is sourced from PubChem (CID 13212019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).