3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine

C16H15NO — CID 6540049

IUPAC3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine
SMILESCOc1ccc2c(c1)CCC(c1cccnc1)=C2
InChIInChI=1S/C16H15NO/c1-18-16-7-6-12-9-13(4-5-14(12)10-16)15-3-2-8-17-11-15/h2-3,6-11H,4-5H2,1H3
InChIKeyWUTGTMFGCHNUET-UHFFFAOYSA-N
MW237.30 g/mol
LogP3.58
Rot. Bonds2

About 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine

3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine (PubChem CID 6540049) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine.

Molecular Properties

Compound Name3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine
PubChem CID6540049
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine
SMILESCOc1ccc2c(c1)CCC(c1cccnc1)=C2
InChIInChI=1S/C16H15NO/c1-18-16-7-6-12-9-13(4-5-14(12)10-16)15-3-2-8-17-11-15/h2-3,6-11H,4-5H2,1H3
InChIKeyWUTGTMFGCHNUET-UHFFFAOYSA-N
XLogP3.58
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine?
The IUPAC name of 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine (CID 6540049) is 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine.
What is the SMILES notation for 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine?
The canonical SMILES for 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine is COc1ccc2c(c1)CCC(c1cccnc1)=C2.
What is the InChIKey of 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine?
The InChIKey is WUTGTMFGCHNUET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c1-18-16-7-6-12-9-13(4-5-14(12)10-16)15-3-2-8-17-11-15/h2-3,6-11H,4-5H2,1H3.
What are the key properties of 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine?
3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine has a molecular weight of 237.30 g/mol, XLogP of 3.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)pyridine is sourced from PubChem (CID 6540049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).