(1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine

C10H13NO2 — CID 162844675

IUPAC(1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine
SMILESCO[C@H]1OCCc2ccnc(C)c21
InChIInChI=1S/C10H13NO2/c1-7-9-8(3-5-11-7)4-6-13-10(9)12-2/h3,5,10H,4,6H2,1-2H3/t10-/m0/s1
InChIKeyARIZYLSCDPQLSY-JTQLQIEISA-N
MW179.22 g/mol
LogP1.61
Rot. Bonds1

About (1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine

(1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine (PubChem CID 162844675) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is (1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine.

Molecular Properties

Compound Name(1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine
PubChem CID162844675
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name(1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine
SMILESCO[C@H]1OCCc2ccnc(C)c21
InChIInChI=1S/C10H13NO2/c1-7-9-8(3-5-11-7)4-6-13-10(9)12-2/h3,5,10H,4,6H2,1-2H3/t10-/m0/s1
InChIKeyARIZYLSCDPQLSY-JTQLQIEISA-N
XLogP1.61
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine?
The IUPAC name of (1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine (CID 162844675) is (1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine.
What is the SMILES notation for (1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine?
The canonical SMILES for (1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine is CO[C@H]1OCCc2ccnc(C)c21.
What is the InChIKey of (1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine?
The InChIKey is ARIZYLSCDPQLSY-JTQLQIEISA-N. The full InChI is InChI=1S/C10H13NO2/c1-7-9-8(3-5-11-7)4-6-13-10(9)12-2/h3,5,10H,4,6H2,1-2H3/t10-/m0/s1.
What are the key properties of (1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine?
(1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine has a molecular weight of 179.22 g/mol, XLogP of 1.61, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-methoxy-8-methyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine is sourced from PubChem (CID 162844675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).