2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine

C19H25N3O2 — CID 146288429

IUPAC2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine
SMILESCOc1cccc(C[C@H]2CCN(C(C)c3cccc(OC)n3)C2)n1
InChIInChI=1S/C19H25N3O2/c1-14(17-7-5-9-19(21-17)24-3)22-11-10-15(13-22)12-16-6-4-8-18(20-16)23-2/h4-9,14-15H,10-13H2,1-3H3/t14?,15-/m1/s1
InChIKeyYMTNJEJLMJGRIP-YSSOQSIOSA-N
MW327.43 g/mol
LogP3.12
Rot. Bonds6

About 2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine

2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine (PubChem CID 146288429) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine.

Molecular Properties

Compound Name2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine
PubChem CID146288429
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine
SMILESCOc1cccc(C[C@H]2CCN(C(C)c3cccc(OC)n3)C2)n1
InChIInChI=1S/C19H25N3O2/c1-14(17-7-5-9-19(21-17)24-3)22-11-10-15(13-22)12-16-6-4-8-18(20-16)23-2/h4-9,14-15H,10-13H2,1-3H3/t14?,15-/m1/s1
InChIKeyYMTNJEJLMJGRIP-YSSOQSIOSA-N
XLogP3.12
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine?
The IUPAC name of 2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine (CID 146288429) is 2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine.
What is the SMILES notation for 2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine?
The canonical SMILES for 2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine is COc1cccc(C[C@H]2CCN(C(C)c3cccc(OC)n3)C2)n1.
What is the InChIKey of 2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine?
The InChIKey is YMTNJEJLMJGRIP-YSSOQSIOSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-14(17-7-5-9-19(21-17)24-3)22-11-10-15(13-22)12-16-6-4-8-18(20-16)23-2/h4-9,14-15H,10-13H2,1-3H3/t14?,15-/m1/s1.
What are the key properties of 2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine?
2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine has a molecular weight of 327.43 g/mol, XLogP of 3.12, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-[[(3R)-1-[1-(6-methoxy-2-pyridinyl)ethyl]pyrrolidin-3-yl]methyl]pyridine is sourced from PubChem (CID 146288429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).