2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine

C15H19NO2 — CID 12849306

IUPAC2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine
SMILESCOc1cc2ccc(CCN)cc2c(C)c1OC
InChIInChI=1S/C15H19NO2/c1-10-13-8-11(6-7-16)4-5-12(13)9-14(17-2)15(10)18-3/h4-5,8-9H,6-7,16H2,1-3H3
InChIKeyBJWMCSHSEUOXNB-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.67
Rot. Bonds4

About 2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine

2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine (PubChem CID 12849306) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine.

Molecular Properties

Compound Name2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine
PubChem CID12849306
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine
SMILESCOc1cc2ccc(CCN)cc2c(C)c1OC
InChIInChI=1S/C15H19NO2/c1-10-13-8-11(6-7-16)4-5-12(13)9-14(17-2)15(10)18-3/h4-5,8-9H,6-7,16H2,1-3H3
InChIKeyBJWMCSHSEUOXNB-UHFFFAOYSA-N
XLogP2.67
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-acetyloxy-6-(2-aminoethyl)-4-methylnaphthalen-2-yl] acetate;hydrochloride
CID 70550498
1,2,3-trimethoxy-7-propylnaphthalene
CID 150838328
2-(3-methoxy-4-methylphenyl)ethanamine
CID 13015320
2,3,6,7-tetramethoxy-1-methylnaphthalene
CID 163473055
2-(3,4-dimethoxyphenyl)ethanamine;hydroiodide
CID 46741035
2-[3-(3,5-dimethylphenyl)-4-methoxyphenyl]ethanamine
CID 82120363
4-(2-aminoethyl)-2-methoxyaniline;dihydrochloride
CID 122360118
2-[4-methoxy-3-(2-methylphenyl)phenyl]ethanamine
CID 82038847
2-[3-(3,4-dimethylphenyl)-4-methoxyphenyl]ethanamine
CID 82107025
5-(2-aminoethyl)-2-methoxyphenol chloride
CID 53313231
2-[6-(2-aminoethyl)naphthalen-2-yl]ethanamine
CID 20633654
2-(2,5-dimethoxy-3,4-dimethylphenyl)ethanamine
CID 22238091

Frequently Asked Questions

What is the IUPAC name of 2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine?
The IUPAC name of 2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine (CID 12849306) is 2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine.
What is the SMILES notation for 2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine?
The canonical SMILES for 2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine is COc1cc2ccc(CCN)cc2c(C)c1OC.
What is the InChIKey of 2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine?
The InChIKey is BJWMCSHSEUOXNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-10-13-8-11(6-7-16)4-5-12(13)9-14(17-2)15(10)18-3/h4-5,8-9H,6-7,16H2,1-3H3.
What are the key properties of 2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine?
2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine has a molecular weight of 245.32 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,7-dimethoxy-8-methylnaphthalen-2-yl)ethanamine is sourced from PubChem (CID 12849306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).