methoxy-(6-methoxynaphthalen-2-yl)methanamine

C13H15NO2 — CID 116947369

IUPACmethoxy-(6-methoxynaphthalen-2-yl)methanamine
SMILESCOc1ccc2cc(C(N)OC)ccc2c1
InChIInChI=1S/C13H15NO2/c1-15-12-6-5-9-7-11(13(14)16-2)4-3-10(9)8-12/h3-8,13H,14H2,1-2H3
InChIKeySEWXVUFUQABYPT-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.45
Rot. Bonds3

About methoxy-(6-methoxynaphthalen-2-yl)methanamine

methoxy-(6-methoxynaphthalen-2-yl)methanamine (PubChem CID 116947369) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is methoxy-(6-methoxynaphthalen-2-yl)methanamine.

Molecular Properties

Compound Namemethoxy-(6-methoxynaphthalen-2-yl)methanamine
PubChem CID116947369
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Namemethoxy-(6-methoxynaphthalen-2-yl)methanamine
SMILESCOc1ccc2cc(C(N)OC)ccc2c1
InChIInChI=1S/C13H15NO2/c1-15-12-6-5-9-7-11(13(14)16-2)4-3-10(9)8-12/h3-8,13H,14H2,1-2H3
InChIKeySEWXVUFUQABYPT-UHFFFAOYSA-N
XLogP2.45
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

amino-(6-methoxynaphthalen-2-yl)methanol
CID 116939708
1-(6-methoxynaphthalen-2-yl)propan-1-amine
CID 57010651
(1S)-1-(6-methoxynaphthalen-2-yl)propan-1-amine;hydrochloride
CID 171218899
(1R)-1-(6-methoxynaphthalen-2-yl)ethane-1,2-diamine;hydrochloride
CID 171218891
methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate
CID 54022420
(2S)-2-(6-methoxynaphthalen-2-yl)propan-1-amine
CID 93286235
(1S)-3,3-difluoro-1-(6-methoxynaphthalen-2-yl)propan-1-amine
CID 171312841
(1S)-2-amino-1-(6-methoxynaphthalen-2-yl)ethanol
CID 28743407
1,3-diamino-1-(6-methoxynaphthalen-2-yl)propan-2-ol
CID 116942613
(S)-(6-methoxynaphthalen-2-yl)-thiophen-2-ylmethanamine
CID 171199401
(1S)-3,3,3-trifluoro-1-(6-methoxynaphthalen-2-yl)propan-1-amine;hydrochloride
CID 171218913
(3R)-3-amino-3-(6-methoxynaphthalen-2-yl)propanamide
CID 29060145

Frequently Asked Questions

What is the IUPAC name of methoxy-(6-methoxynaphthalen-2-yl)methanamine?
The IUPAC name of methoxy-(6-methoxynaphthalen-2-yl)methanamine (CID 116947369) is methoxy-(6-methoxynaphthalen-2-yl)methanamine.
What is the SMILES notation for methoxy-(6-methoxynaphthalen-2-yl)methanamine?
The canonical SMILES for methoxy-(6-methoxynaphthalen-2-yl)methanamine is COc1ccc2cc(C(N)OC)ccc2c1.
What is the InChIKey of methoxy-(6-methoxynaphthalen-2-yl)methanamine?
The InChIKey is SEWXVUFUQABYPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-15-12-6-5-9-7-11(13(14)16-2)4-3-10(9)8-12/h3-8,13H,14H2,1-2H3.
What are the key properties of methoxy-(6-methoxynaphthalen-2-yl)methanamine?
methoxy-(6-methoxynaphthalen-2-yl)methanamine has a molecular weight of 217.27 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-(6-methoxynaphthalen-2-yl)methanamine is sourced from PubChem (CID 116947369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).