4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine

C18H17NO2 — CID 25034492

IUPAC4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine
SMILESCOCc1ccncc1-c1ccc2cc(OC)ccc2c1
InChIInChI=1S/C18H17NO2/c1-20-12-16-7-8-19-11-18(16)15-4-3-14-10-17(21-2)6-5-13(14)9-15/h3-11H,12H2,1-2H3
InChIKeyKEAUPIRQRIXNOR-UHFFFAOYSA-N
MW279.34 g/mol
LogP4.06
Rot. Bonds4

About 4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine

4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine (PubChem CID 25034492) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine.

Molecular Properties

Compound Name4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine
PubChem CID25034492
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine
SMILESCOCc1ccncc1-c1ccc2cc(OC)ccc2c1
InChIInChI=1S/C18H17NO2/c1-20-12-16-7-8-19-11-18(16)15-4-3-14-10-17(21-2)6-5-13(14)9-15/h3-11H,12H2,1-2H3
InChIKeyKEAUPIRQRIXNOR-UHFFFAOYSA-N
XLogP4.06
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine?
The IUPAC name of 4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine (CID 25034492) is 4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine.
What is the SMILES notation for 4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine?
The canonical SMILES for 4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine is COCc1ccncc1-c1ccc2cc(OC)ccc2c1.
What is the InChIKey of 4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine?
The InChIKey is KEAUPIRQRIXNOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-20-12-16-7-8-19-11-18(16)15-4-3-14-10-17(21-2)6-5-13(14)9-15/h3-11H,12H2,1-2H3.
What are the key properties of 4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine?
4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine has a molecular weight of 279.34 g/mol, XLogP of 4.06, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-3-(6-methoxynaphthalen-2-yl)pyridine is sourced from PubChem (CID 25034492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).