7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine

C24H28N8O2 — CID 170324616

IUPAC7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine
SMILESCc1c(N2CCc3cnc(Nc4ccnc(N5CCOCC5)c4)nc3C2)cnc2c1NCCO2
InChIInChI=1S/C24H28N8O2/c1-16-20(14-27-23-22(16)26-5-9-34-23)32-6-3-17-13-28-24(30-19(17)15-32)29-18-2-4-25-21(12-18)31-7-10-33-11-8-31/h2,4,12-14,26H,3,5-11,15H2,1H3,(H,25,28,29,30)
InChIKeyRLWIJMRYRCLDMH-UHFFFAOYSA-N
MW460.54 g/mol
LogP2.52
Rot. Bonds4

About 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine

7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine (PubChem CID 170324616) has the molecular formula C24H28N8O2 and a molecular weight of 460.54 g/mol. Its IUPAC name is 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine.

Molecular Properties

Compound Name7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine
PubChem CID170324616
Molecular FormulaC24H28N8O2
Molecular Weight460.54 g/mol
Exact Mass460.23
IUPAC Name7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine
SMILESCc1c(N2CCc3cnc(Nc4ccnc(N5CCOCC5)c4)nc3C2)cnc2c1NCCO2
InChIInChI=1S/C24H28N8O2/c1-16-20(14-27-23-22(16)26-5-9-34-23)32-6-3-17-13-28-24(30-19(17)15-32)29-18-2-4-25-21(12-18)31-7-10-33-11-8-31/h2,4,12-14,26H,3,5-11,15H2,1H3,(H,25,28,29,30)
InChIKeyRLWIJMRYRCLDMH-UHFFFAOYSA-N
XLogP2.52
TPSA100.56 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.54
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine?
The IUPAC name of 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine (CID 170324616) is 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine.
What is the SMILES notation for 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine?
The canonical SMILES for 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine is Cc1c(N2CCc3cnc(Nc4ccnc(N5CCOCC5)c4)nc3C2)cnc2c1NCCO2.
What is the InChIKey of 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine?
The InChIKey is RLWIJMRYRCLDMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N8O2/c1-16-20(14-27-23-22(16)26-5-9-34-23)32-6-3-17-13-28-24(30-19(17)15-32)29-18-2-4-25-21(12-18)31-7-10-33-11-8-31/h2,4,12-14,26H,3,5-11,15H2,1H3,(H,25,28,29,30).
What are the key properties of 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine?
7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine has a molecular weight of 460.54 g/mol, XLogP of 2.52, 4 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-(2-morpholin-4-yl-4-pyridinyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-amine is sourced from PubChem (CID 170324616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).