3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine

C18H19NO — CID 18540833

IUPAC3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine
SMILESCOc1ccc2c(c1)C(C)=C(Cc1cccnc1)CC2
InChIInChI=1S/C18H19NO/c1-13-16(10-14-4-3-9-19-12-14)6-5-15-7-8-17(20-2)11-18(13)15/h3-4,7-9,11-12H,5-6,10H2,1-2H3
InChIKeyBYUUDXWTDQHHKB-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.05
Rot. Bonds3

About 3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine

3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine (PubChem CID 18540833) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is 3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine.

Molecular Properties

Compound Name3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine
PubChem CID18540833
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine
SMILESCOc1ccc2c(c1)C(C)=C(Cc1cccnc1)CC2
InChIInChI=1S/C18H19NO/c1-13-16(10-14-4-3-9-19-12-14)6-5-15-7-8-17(20-2)11-18(13)15/h3-4,7-9,11-12H,5-6,10H2,1-2H3
InChIKeyBYUUDXWTDQHHKB-UHFFFAOYSA-N
XLogP4.05
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)acetic acid
CID 19048915
3-amino-5-methoxy-2-(pyridin-3-ylmethyl)inden-1-one
CID 10563688
7-methoxy-N-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115510305
(3Z)-5-methoxy-3-(6-methoxy-2,3-dihydroinden-1-ylidene)-1,2-dihydroindene
CID 125266195
7-methoxy-2-(pyridin-3-ylmethyl)chromen-4-one
CID 127027266
1-(4-methoxy-2-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 65313099
3-[(7-methoxynaphthalen-2-yl)oxymethyl]pyridine
CID 166203848
3-(pyridin-3-ylmethyl)pyridine
CID 14762640
5-methoxy-2-methyl-N-(pyridin-3-ylmethyl)aniline;molecular hydrogen
CID 144774827
4-[(2Z)-2-(7-methoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetyl]-N-(pyridin-3-ylmethyl)benzamide
CID 69212628
ethane;5-methoxytricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-one
CID 90841573
(2,4-dimethoxyphenyl)methyl-(pyridin-3-ylmethyl)azanium
CID 5045085

Frequently Asked Questions

What is the IUPAC name of 3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine?
The IUPAC name of 3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine (CID 18540833) is 3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine.
What is the SMILES notation for 3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine?
The canonical SMILES for 3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine is COc1ccc2c(c1)C(C)=C(Cc1cccnc1)CC2.
What is the InChIKey of 3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine?
The InChIKey is BYUUDXWTDQHHKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c1-13-16(10-14-4-3-9-19-12-14)6-5-15-7-8-17(20-2)11-18(13)15/h3-4,7-9,11-12H,5-6,10H2,1-2H3.
What are the key properties of 3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine?
3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine has a molecular weight of 265.36 g/mol, XLogP of 4.05, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)methyl]pyridine is sourced from PubChem (CID 18540833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).