3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one

C11H15NO2 — CID 102223817

IUPAC3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one
SMILESCCCC1=CC2=CCCCN2C(=O)O1
InChIInChI=1S/C11H15NO2/c1-2-5-10-8-9-6-3-4-7-12(9)11(13)14-10/h6,8H,2-5,7H2,1H3
InChIKeyQPBFLYRJILBNEK-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.80
Rot. Bonds2

About 3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one

3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one (PubChem CID 102223817) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one.

Molecular Properties

Compound Name3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one
PubChem CID102223817
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one
SMILESCCCC1=CC2=CCCCN2C(=O)O1
InChIInChI=1S/C11H15NO2/c1-2-5-10-8-9-6-3-4-7-12(9)11(13)14-10/h6,8H,2-5,7H2,1H3
InChIKeyQPBFLYRJILBNEK-UHFFFAOYSA-N
XLogP2.80
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one?
The IUPAC name of 3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one (CID 102223817) is 3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one.
What is the SMILES notation for 3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one?
The canonical SMILES for 3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one is CCCC1=CC2=CCCCN2C(=O)O1.
What is the InChIKey of 3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one?
The InChIKey is QPBFLYRJILBNEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-2-5-10-8-9-6-3-4-7-12(9)11(13)14-10/h6,8H,2-5,7H2,1H3.
What are the key properties of 3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one?
3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one has a molecular weight of 193.25 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propyl-7,8-dihydro-6H-pyrido[1,2-c][1,3]oxazin-1-one is sourced from PubChem (CID 102223817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).