2-pyridin-3-yl-1,3-oxazinane

C9H12N2O — CID 14893319

IUPAC2-pyridin-3-yl-1,3-oxazinane
SMILESc1cncc(C2NCCCO2)c1
InChIInChI=1S/C9H12N2O/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h1,3-4,7,9,11H,2,5-6H2
InChIKeyONDUWKPTSDZIPB-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.09
Rot. Bonds1

About 2-pyridin-3-yl-1,3-oxazinane

2-pyridin-3-yl-1,3-oxazinane (PubChem CID 14893319) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 2-pyridin-3-yl-1,3-oxazinane.

Molecular Properties

Compound Name2-pyridin-3-yl-1,3-oxazinane
PubChem CID14893319
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name2-pyridin-3-yl-1,3-oxazinane
SMILESc1cncc(C2NCCCO2)c1
InChIInChI=1S/C9H12N2O/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h1,3-4,7,9,11H,2,5-6H2
InChIKeyONDUWKPTSDZIPB-UHFFFAOYSA-N
XLogP1.09
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2S)-aziridin-2-yl]pyridine
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(2R)-2-pyridin-4-yl-1,3-oxazolidine
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2-pyridin-3-yl-2,4-dihydro-1H-3,1-benzoxazine
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(2S,3S)-2-pyridin-3-yloxolan-3-amine
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3-pyrrolidin-3-ylpyridine
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2-pyridin-3-yl-2,3-dihydro-1,3-oxazole
CID 173212997
2-pyridin-3-ylpiperazine
CID 3872289
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CID 175134059
2-pyridin-3-ylpiperidine-3-carboxylic acid
CID 83916473
3-pyridin-3-ylthiomorpholine
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4-pyridin-3-ylazepane
CID 83262248

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-3-yl-1,3-oxazinane?
The IUPAC name of 2-pyridin-3-yl-1,3-oxazinane (CID 14893319) is 2-pyridin-3-yl-1,3-oxazinane.
What is the SMILES notation for 2-pyridin-3-yl-1,3-oxazinane?
The canonical SMILES for 2-pyridin-3-yl-1,3-oxazinane is c1cncc(C2NCCCO2)c1.
What is the InChIKey of 2-pyridin-3-yl-1,3-oxazinane?
The InChIKey is ONDUWKPTSDZIPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h1,3-4,7,9,11H,2,5-6H2.
What are the key properties of 2-pyridin-3-yl-1,3-oxazinane?
2-pyridin-3-yl-1,3-oxazinane has a molecular weight of 164.21 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-yl-1,3-oxazinane is sourced from PubChem (CID 14893319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).