1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine

C8H15NO — CID 23278629

IUPAC1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine
SMILESC1CCN2COCCC2C1
InChIInChI=1S/C8H15NO/c1-2-5-9-7-10-6-4-8(9)3-1/h8H,1-7H2
InChIKeyQNXMMEGQRQOPEF-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.22
Rot. Bonds

About 1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine

1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine (PubChem CID 23278629) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine.

Molecular Properties

Compound Name1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine
PubChem CID23278629
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine
SMILESC1CCN2COCCC2C1
InChIInChI=1S/C8H15NO/c1-2-5-9-7-10-6-4-8(9)3-1/h8H,1-7H2
InChIKeyQNXMMEGQRQOPEF-UHFFFAOYSA-N
XLogP1.22
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 127721176
(4R)-4-methyl-1-(oxan-4-yl)azepane
CID 66580615
4-methyl-1-(oxan-4-yl)azepane
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CID 146561161

Frequently Asked Questions

What is the IUPAC name of 1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine?
The IUPAC name of 1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine (CID 23278629) is 1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine.
What is the SMILES notation for 1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine?
The canonical SMILES for 1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine is C1CCN2COCCC2C1.
What is the InChIKey of 1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine?
The InChIKey is QNXMMEGQRQOPEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-2-5-9-7-10-6-4-8(9)3-1/h8H,1-7H2.
What are the key properties of 1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine?
1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine has a molecular weight of 141.21 g/mol, XLogP of 1.22, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,4,4a,5,6,7,8-octahydropyrido[1,2-c][1,3]oxazine is sourced from PubChem (CID 23278629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).