6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine

C16H15NO — CID 69365055

IUPAC6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine
SMILESCOc1ccc(C2=CCCC=N2)c2ccccc12
InChIInChI=1S/C16H15NO/c1-18-16-10-9-13(15-8-4-5-11-17-15)12-6-2-3-7-14(12)16/h2-3,6-11H,4-5H2,1H3
InChIKeyJBXLKDXAORHZHB-UHFFFAOYSA-N
MW237.30 g/mol
LogP4.05
Rot. Bonds2

About 6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine

6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine (PubChem CID 69365055) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is 6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine.

Molecular Properties

Compound Name6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine
PubChem CID69365055
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine
SMILESCOc1ccc(C2=CCCC=N2)c2ccccc12
InChIInChI=1S/C16H15NO/c1-18-16-10-9-13(15-8-4-5-11-17-15)12-6-2-3-7-14(12)16/h2-3,6-11H,4-5H2,1H3
InChIKeyJBXLKDXAORHZHB-UHFFFAOYSA-N
XLogP4.05
TPSA21.59 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 ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-Methoxyphenyliminomethyl)-2-naphthol
CID 307166
4-Methoxynaphthalen-1-ylmethylamine
CID 59139
4-methoxy-N-[(2-methoxy-1-naphthyl)methylene]aniline
CID 693450
8-methoxy-5-(4-methoxy-1-naphthyl)-3,3-dimethyl-4H-isoquinoline
CID 49845217
8-Methoxy-5-(4-methoxy-1-naphthyl)-3,4-dihydroisoquinoline
CID 49845218
(3R)-8-methoxy-1,3-dimethyl-5-phenyl-3,4-dihydroisoquinoline
CID 49845571
(3R)-8-methoxy-1,3-dimethyl-5-(p-tolyl)-3,4-dihydroisoquinoline
CID 49845723
(3R)-8-methoxy-1,3-dimethyl-5-(1-naphthyl)-3,4-dihydroisoquinoline
CID 49845879
(3R)-8-methoxy-1,3-dimethyl-5-(2-naphthyl)-3,4-dihydroisoquinoline
CID 49845881
(2-Methoxynaphthalen-1-yl)methanamine
CID 6483887
3,4-Dihydroisoquinoline, 1-[3-methoxybenzyl]-6-methoxy-
CID 624494
1-(2-Methoxyphenyliminomethyl)-2-naphthol
CID 690825

Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine?
The IUPAC name of 6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine (CID 69365055) is 6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine.
What is the SMILES notation for 6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine?
The canonical SMILES for 6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine is COc1ccc(C2=CCCC=N2)c2ccccc12.
What is the InChIKey of 6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine?
The InChIKey is JBXLKDXAORHZHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c1-18-16-10-9-13(15-8-4-5-11-17-15)12-6-2-3-7-14(12)16/h2-3,6-11H,4-5H2,1H3.
What are the key properties of 6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine?
6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine has a molecular weight of 237.30 g/mol, XLogP of 4.05, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxynaphthalen-1-yl)-3,4-dihydropyridine is sourced from PubChem (CID 69365055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).