1-(7-methoxynaphthalen-1-yl)ethanamine

C13H15NO — CID 20542005

IUPAC1-(7-methoxynaphthalen-1-yl)ethanamine
SMILESCOc1ccc2cccc(C(C)N)c2c1
InChIInChI=1S/C13H15NO/c1-9(14)12-5-3-4-10-6-7-11(15-2)8-13(10)12/h3-9H,14H2,1-2H3
InChIKeyZSOJQCWGIFHAIN-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.87
Rot. Bonds2

About 1-(7-methoxynaphthalen-1-yl)ethanamine

1-(7-methoxynaphthalen-1-yl)ethanamine (PubChem CID 20542005) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 1-(7-methoxynaphthalen-1-yl)ethanamine.

Molecular Properties

Compound Name1-(7-methoxynaphthalen-1-yl)ethanamine
PubChem CID20542005
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name1-(7-methoxynaphthalen-1-yl)ethanamine
SMILESCOc1ccc2cccc(C(C)N)c2c1
InChIInChI=1S/C13H15NO/c1-9(14)12-5-3-4-10-6-7-11(15-2)8-13(10)12/h3-9H,14H2,1-2H3
InChIKeyZSOJQCWGIFHAIN-UHFFFAOYSA-N
XLogP2.87
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(7-methoxynaphthalen-1-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(7-methoxynaphthalen-1-yl)-2-methylbutan-2-amine
CID 67652493
3-(7-methoxynaphthalen-1-yl)butanamide
CID 57236760
2-(7-methoxynaphthalen-1-yl)butanamide
CID 57299738
2-(7-methoxynaphthalen-1-yl)hexanamide
CID 57317749
1-(7-methoxynaphthalen-1-yl)-3-propan-2-yloxypropan-2-amine
CID 115506207
8-[(1R)-1-aminoethyl]naphthalene-2-carbonitrile;hydrochloride
CID 121237512
deuterium monohydride;(1R)-1-naphthalen-1-ylethanamine
CID 158157747
(2-bromo-5-methoxyphenyl)-naphthalen-1-ylmethanamine
CID 105141322
3-(7-methoxynaphthalen-1-yl)heptanamide
CID 57192600
1-(7-methoxynaphthalen-1-yl)-3-methylbut-3-en-2-amine
CID 115506222
1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine
CID 115506198
1-tert-butyl-7-methoxynaphthalene
CID 608110

Frequently Asked Questions

What is the IUPAC name of 1-(7-methoxynaphthalen-1-yl)ethanamine?
The IUPAC name of 1-(7-methoxynaphthalen-1-yl)ethanamine (CID 20542005) is 1-(7-methoxynaphthalen-1-yl)ethanamine.
What is the SMILES notation for 1-(7-methoxynaphthalen-1-yl)ethanamine?
The canonical SMILES for 1-(7-methoxynaphthalen-1-yl)ethanamine is COc1ccc2cccc(C(C)N)c2c1.
What is the InChIKey of 1-(7-methoxynaphthalen-1-yl)ethanamine?
The InChIKey is ZSOJQCWGIFHAIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-9(14)12-5-3-4-10-6-7-11(15-2)8-13(10)12/h3-9H,14H2,1-2H3.
What are the key properties of 1-(7-methoxynaphthalen-1-yl)ethanamine?
1-(7-methoxynaphthalen-1-yl)ethanamine has a molecular weight of 201.27 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-methoxynaphthalen-1-yl)ethanamine is sourced from PubChem (CID 20542005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).