2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine

C22H32N2O2 — CID 11081516

IUPAC2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine
SMILESCO[C@@H](c1cccc(-c2cccc([C@H](OC)C(C)(C)C)n2)n1)C(C)(C)C
InChIInChI=1S/C22H32N2O2/c1-21(2,3)19(25-7)17-13-9-11-15(23-17)16-12-10-14-18(24-16)20(26-8)22(4,5)6/h9-14,19-20H,1-8H3/t19-,20-/m0/s1
InChIKeyJVQAUJLRMUPOBF-PMACEKPBSA-N
MW356.51 g/mol
LogP5.61
Rot. Bonds5

About 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine

2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine (PubChem CID 11081516) has the molecular formula C22H32N2O2 and a molecular weight of 356.51 g/mol. Its IUPAC name is 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine.

Molecular Properties

Compound Name2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine
PubChem CID11081516
Molecular FormulaC22H32N2O2
Molecular Weight356.51 g/mol
Exact Mass356.25
IUPAC Name2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine
SMILESCO[C@@H](c1cccc(-c2cccc([C@H](OC)C(C)(C)C)n2)n1)C(C)(C)C
InChIInChI=1S/C22H32N2O2/c1-21(2,3)19(25-7)17-13-9-11-15(23-17)16-12-10-14-18(24-16)20(26-8)22(4,5)6/h9-14,19-20H,1-8H3/t19-,20-/m0/s1
InChIKeyJVQAUJLRMUPOBF-PMACEKPBSA-N
XLogP5.61
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.51
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine?
The IUPAC name of 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine (CID 11081516) is 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine.
What is the SMILES notation for 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine?
The canonical SMILES for 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine is CO[C@@H](c1cccc(-c2cccc([C@H](OC)C(C)(C)C)n2)n1)C(C)(C)C.
What is the InChIKey of 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine?
The InChIKey is JVQAUJLRMUPOBF-PMACEKPBSA-N. The full InChI is InChI=1S/C22H32N2O2/c1-21(2,3)19(25-7)17-13-9-11-15(23-17)16-12-10-14-18(24-16)20(26-8)22(4,5)6/h9-14,19-20H,1-8H3/t19-,20-/m0/s1.
What are the key properties of 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine?
2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine has a molecular weight of 356.51 g/mol, XLogP of 5.61, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-1-methoxy-2,2-dimethylpropyl]-6-[6-[(1R)-1-methoxy-2,2-dimethylpropyl]-2-pyridinyl]pyridine is sourced from PubChem (CID 11081516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).