6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine

C12H18N2O — CID 102542565

IUPAC6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine
SMILESCOc1ccc(C2CCCN2C)c(C)n1
InChIInChI=1S/C12H18N2O/c1-9-10(6-7-12(13-9)15-3)11-5-4-8-14(11)2/h6-7,11H,4-5,8H2,1-3H3
InChIKeyNIGJOFKDRUVRBO-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.17
Rot. Bonds2

About 6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine

6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine (PubChem CID 102542565) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine.

Molecular Properties

Compound Name6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine
PubChem CID102542565
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine
SMILESCOc1ccc(C2CCCN2C)c(C)n1
InChIInChI=1S/C12H18N2O/c1-9-10(6-7-12(13-9)15-3)11-5-4-8-14(11)2/h6-7,11H,4-5,8H2,1-3H3
InChIKeyNIGJOFKDRUVRBO-UHFFFAOYSA-N
XLogP2.17
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine?
The IUPAC name of 6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine (CID 102542565) is 6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine.
What is the SMILES notation for 6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine?
The canonical SMILES for 6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine is COc1ccc(C2CCCN2C)c(C)n1.
What is the InChIKey of 6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine?
The InChIKey is NIGJOFKDRUVRBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9-10(6-7-12(13-9)15-3)11-5-4-8-14(11)2/h6-7,11H,4-5,8H2,1-3H3.
What are the key properties of 6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine?
6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine has a molecular weight of 206.29 g/mol, XLogP of 2.17, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)pyridine is sourced from PubChem (CID 102542565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).