2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one

C15H21N3O2 — CID 118260967

IUPAC2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one
SMILESCC(C)c1cnc2c(c1)OC(C1CCNCC1)C(=O)N2
InChIInChI=1S/C15H21N3O2/c1-9(2)11-7-12-14(17-8-11)18-15(19)13(20-12)10-3-5-16-6-4-10/h7-10,13,16H,3-6H2,1-2H3,(H,17,18,19)
InChIKeyIGKVRCYRQXSTDJ-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.90
Rot. Bonds2

About 2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one

2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one (PubChem CID 118260967) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one.

Molecular Properties

Compound Name2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one
PubChem CID118260967
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one
SMILESCC(C)c1cnc2c(c1)OC(C1CCNCC1)C(=O)N2
InChIInChI=1S/C15H21N3O2/c1-9(2)11-7-12-14(17-8-11)18-15(19)13(20-12)10-3-5-16-6-4-10/h7-10,13,16H,3-6H2,1-2H3,(H,17,18,19)
InChIKeyIGKVRCYRQXSTDJ-UHFFFAOYSA-N
XLogP1.90
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one?
The IUPAC name of 2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one (CID 118260967) is 2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one.
What is the SMILES notation for 2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one?
The canonical SMILES for 2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one is CC(C)c1cnc2c(c1)OC(C1CCNCC1)C(=O)N2.
What is the InChIKey of 2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one?
The InChIKey is IGKVRCYRQXSTDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-9(2)11-7-12-14(17-8-11)18-15(19)13(20-12)10-3-5-16-6-4-10/h7-10,13,16H,3-6H2,1-2H3,(H,17,18,19).
What are the key properties of 2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one?
2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one has a molecular weight of 275.35 g/mol, XLogP of 1.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-yl-7-propan-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one is sourced from PubChem (CID 118260967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).