2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine

C13H17NO — CID 83832198

IUPAC2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine
SMILESCOc1ccc2c(c1)C=C(CCN)CC2
InChIInChI=1S/C13H17NO/c1-15-13-5-4-11-3-2-10(6-7-14)8-12(11)9-13/h4-5,8-9H,2-3,6-7,14H2,1H3
InChIKeyJQICZXAKFLXEIA-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.37
Rot. Bonds3

About 2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine

2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine (PubChem CID 83832198) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is 2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine.

Molecular Properties

Compound Name2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine
PubChem CID83832198
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine
SMILESCOc1ccc2c(c1)C=C(CCN)CC2
InChIInChI=1S/C13H17NO/c1-15-13-5-4-11-3-2-10(6-7-14)8-12(11)9-13/h4-5,8-9H,2-3,6-7,14H2,1H3
InChIKeyJQICZXAKFLXEIA-UHFFFAOYSA-N
XLogP2.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-3-(7-methoxy-3,4-dihydronaphthalen-2-yl)propane-1,2-diamine
CID 129386115
3,6-dimethoxy-1,2-dihydronaphthalene
CID 13364263
3-(6-methoxy-3,4-dihydronaphthalen-2-yl)propane-1,2-diamine
CID 10681104
7-methoxy-3,4-dihydronaphthalene-2-carboxylic acid
CID 67598336
5-methoxy-2-methyl-1H-indene
CID 12616525
but-2-enedioic acid;5-[(7-methoxy-3,4-dihydronaphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole
CID 70271646
6-methoxy-3-methyl-1,2-dihydroisoquinoline
CID 69142122
methyl 7-(2-pyrrolidin-1-ylethyl)-5,6-dihydronaphthalene-2-carboxylate
CID 22104515
2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethanamine
CID 10900371
(3Z)-5-methoxy-3-(6-methoxy-2,3-dihydroinden-1-ylidene)-1,2-dihydroindene
CID 125266195
7-methoxy-3-(trifluoromethyl)-1,2-dihydronaphthalene
CID 132552094
2-(2-bromo-5-methoxyphenyl)ethanamine
CID 46831332

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine?
The IUPAC name of 2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine (CID 83832198) is 2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine.
What is the SMILES notation for 2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine?
The canonical SMILES for 2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine is COc1ccc2c(c1)C=C(CCN)CC2.
What is the InChIKey of 2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine?
The InChIKey is JQICZXAKFLXEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-15-13-5-4-11-3-2-10(6-7-14)8-12(11)9-13/h4-5,8-9H,2-3,6-7,14H2,1H3.
What are the key properties of 2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine?
2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine has a molecular weight of 203.28 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-3,4-dihydronaphthalen-2-yl)ethanamine is sourced from PubChem (CID 83832198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).