(3R)-2-methoxy-3-methyl-2,3-dihydropyridine

C7H11NO — CID 67991605

IUPAC(3R)-2-methoxy-3-methyl-2,3-dihydropyridine
SMILESCOC1N=CC=C[C@H]1C
InChIInChI=1S/C7H11NO/c1-6-4-3-5-8-7(6)9-2/h3-7H,1-2H3/t6-,7?/m1/s1
InChIKeyOBTCFUAPQWDAED-ULUSZKPHSA-N
MW125.17 g/mol
LogP1.24
Rot. Bonds1

About (3R)-2-methoxy-3-methyl-2,3-dihydropyridine

(3R)-2-methoxy-3-methyl-2,3-dihydropyridine (PubChem CID 67991605) has the molecular formula C7H11NO and a molecular weight of 125.17 g/mol. Its IUPAC name is (3R)-2-methoxy-3-methyl-2,3-dihydropyridine.

Molecular Properties

Compound Name(3R)-2-methoxy-3-methyl-2,3-dihydropyridine
PubChem CID67991605
Molecular FormulaC7H11NO
Molecular Weight125.17 g/mol
Exact Mass125.08
IUPAC Name(3R)-2-methoxy-3-methyl-2,3-dihydropyridine
SMILESCOC1N=CC=C[C@H]1C
InChIInChI=1S/C7H11NO/c1-6-4-3-5-8-7(6)9-2/h3-7H,1-2H3/t6-,7?/m1/s1
InChIKeyOBTCFUAPQWDAED-ULUSZKPHSA-N
XLogP1.24
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-2-methoxy-3-methyl-2,3-dihydropyridine?
The IUPAC name of (3R)-2-methoxy-3-methyl-2,3-dihydropyridine (CID 67991605) is (3R)-2-methoxy-3-methyl-2,3-dihydropyridine.
What is the SMILES notation for (3R)-2-methoxy-3-methyl-2,3-dihydropyridine?
The canonical SMILES for (3R)-2-methoxy-3-methyl-2,3-dihydropyridine is COC1N=CC=C[C@H]1C.
What is the InChIKey of (3R)-2-methoxy-3-methyl-2,3-dihydropyridine?
The InChIKey is OBTCFUAPQWDAED-ULUSZKPHSA-N. The full InChI is InChI=1S/C7H11NO/c1-6-4-3-5-8-7(6)9-2/h3-7H,1-2H3/t6-,7?/m1/s1.
What are the key properties of (3R)-2-methoxy-3-methyl-2,3-dihydropyridine?
(3R)-2-methoxy-3-methyl-2,3-dihydropyridine has a molecular weight of 125.17 g/mol, XLogP of 1.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-2-methoxy-3-methyl-2,3-dihydropyridine is sourced from PubChem (CID 67991605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).