3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine

C88H77F3N22O7 — CID 158310266

IUPAC3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine
SMILESFC(F)(F)c1cccc(N2COc3c(ccc4cccnc34)C2)c1.c1cnc(N2COc3cccnc3C2)nc1.c1cnc(N2COc3ncccc3C2)nc1.c1cnc2c(c1)CN(c1ccncc1)CO2.c1cnc2c(c1)CN(c1ccncc1)CO2.c1cnc2c(c1)OCN(c1ccncc1)C2.c1cncc(N2COc3ncccc3C2)c1
InChIInChI=1S/C18H13F3N2O.4C12H11N3O.2C11H10N4O/c19-18(20,21)14-4-1-5-15(9-14)23-10-13-7-6-12-3-2-8-22-16(12)17(13)24-11-23;1-3-10-8-15(9-16-12(10)14-6-1)11-4-2-5-13-7-11;1-2-12-11(14-5-1)8-15(9-16-12)10-3-6-13-7-4-10;2*1-2-10-8-15(9-16-12(10)14-5-1)11-3-6-13-7-4-11;1-3-10-9(12-4-1)7-15(8-16-10)11-13-5-2-6-14-11;1-3-9-7-15(8-16-10(9)12-4-1)11-13-5-2-6-14-11/h1-9H,10-11H2;4*1-7H,8-9H2;2*1-6H,7-8H2
InChIKeyGNPDMKPJXKJABT-UHFFFAOYSA-N
MW1611.72 g/mol
LogP14.40
Rot. Bonds7

About 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine

3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine (PubChem CID 158310266) has the molecular formula C88H77F3N22O7 and a molecular weight of 1611.72 g/mol. Its IUPAC name is 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine.

Molecular Properties

Compound Name3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine
PubChem CID158310266
Molecular FormulaC88H77F3N22O7
Molecular Weight1611.72 g/mol
Exact Mass1610.63
IUPAC Name3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine
SMILESFC(F)(F)c1cccc(N2COc3c(ccc4cccnc34)C2)c1.c1cnc(N2COc3cccnc3C2)nc1.c1cnc(N2COc3ncccc3C2)nc1.c1cnc2c(c1)CN(c1ccncc1)CO2.c1cnc2c(c1)CN(c1ccncc1)CO2.c1cnc2c(c1)OCN(c1ccncc1)C2.c1cncc(N2COc3ncccc3C2)c1
InChIInChI=1S/C18H13F3N2O.4C12H11N3O.2C11H10N4O/c19-18(20,21)14-4-1-5-15(9-14)23-10-13-7-6-12-3-2-8-22-16(12)17(13)24-11-23;1-3-10-8-15(9-16-12(10)14-6-1)11-4-2-5-13-7-11;1-2-12-11(14-5-1)8-15(9-16-12)10-3-6-13-7-4-10;2*1-2-10-8-15(9-16-12(10)14-5-1)11-3-6-13-7-4-11;1-3-10-9(12-4-1)7-15(8-16-10)11-13-5-2-6-14-11;1-3-9-7-15(8-16-10(9)12-4-1)11-13-5-2-6-14-11/h1-9H,10-11H2;4*1-7H,8-9H2;2*1-6H,7-8H2
InChIKeyGNPDMKPJXKJABT-UHFFFAOYSA-N
XLogP14.40
TPSA280.64 Ų
H-Bond Donors
H-Bond Acceptors29
Rotatable Bonds7
Heavy Atoms120
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001611.72
LogP ≤ 514.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1029

Analyze 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine?
The IUPAC name of 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine (CID 158310266) is 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine.
What is the SMILES notation for 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine?
The canonical SMILES for 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine is FC(F)(F)c1cccc(N2COc3c(ccc4cccnc34)C2)c1.c1cnc(N2COc3cccnc3C2)nc1.c1cnc(N2COc3ncccc3C2)nc1.c1cnc2c(c1)CN(c1ccncc1)CO2.c1cnc2c(c1)CN(c1ccncc1)CO2.c1cnc2c(c1)OCN(c1ccncc1)C2.c1cncc(N2COc3ncccc3C2)c1.
What is the InChIKey of 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine?
The InChIKey is GNPDMKPJXKJABT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F3N2O.4C12H11N3O.2C11H10N4O/c19-18(20,21)14-4-1-5-15(9-14)23-10-13-7-6-12-3-2-8-22-16(12)17(13)24-11-23;1-3-10-8-15(9-16-12(10)14-6-1)11-4-2-5-13-7-11;1-2-12-11(14-5-1)8-15(9-16-12)10-3-6-13-7-4-10;2*1-2-10-8-15(9-16-12(10)14-5-1)11-3-6-13-7-4-11;1-3-10-9(12-4-1)7-15(8-16-10)11-13-5-2-6-14-11;1-3-9-7-15(8-16-10(9)12-4-1)11-13-5-2-6-14-11/h1-9H,10-11H2;4*1-7H,8-9H2;2*1-6H,7-8H2.
What are the key properties of 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine?
3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine has a molecular weight of 1611.72 g/mol, XLogP of 14.40, 7 rotatable bonds, 0 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-[3-(trifluoromethyl)phenyl]-2,4-dihydropyrido[3,2-h][1,3]benzoxazine is sourced from PubChem (CID 158310266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).