N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine

C15H19NO3 — CID 82714997

IUPACN-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine
SMILESCOCCONCc1c(OC)ccc2ccccc12
InChIInChI=1S/C15H19NO3/c1-17-9-10-19-16-11-14-13-6-4-3-5-12(13)7-8-15(14)18-2/h3-8,16H,9-11H2,1-2H3
InChIKeyDEFNXDYCXXUHGB-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.52
Rot. Bonds7

About N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine

N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine (PubChem CID 82714997) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine.

Molecular Properties

Compound NameN-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine
PubChem CID82714997
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC NameN-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine
SMILESCOCCONCc1c(OC)ccc2ccccc12
InChIInChI=1S/C15H19NO3/c1-17-9-10-19-16-11-14-13-6-4-3-5-12(13)7-8-15(14)18-2/h3-8,16H,9-11H2,1-2H3
InChIKeyDEFNXDYCXXUHGB-UHFFFAOYSA-N
XLogP2.52
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(2-methoxynaphthalen-1-yl)-N-[(2-methylpropan-2-yl)oxy]methanamine
CID 82719701
N-(2-methoxyethoxy)-1-naphthalen-1-ylmethanamine
CID 82710702
N-cyclopentyloxy-1-(2-methoxynaphthalen-1-yl)methanamine
CID 83229536
N-[(2-methoxynaphthalen-1-yl)methyl]-2-(2-methylpropoxy)ethanamine
CID 115584591
2-methoxy-1,6-bis[(2-methoxynaphthalen-1-yl)methyl]naphthalene
CID 139095345
N-[[2-(2-methoxyethoxy)naphthalen-1-yl]methyl]propan-1-amine
CID 43505546
methyl 2-[(2-methoxynaphthalen-1-yl)methylamino]propanoate
CID 60780634
3-[(2-methoxynaphthalen-1-yl)methylamino]propanenitrile
CID 43215614
N-[(2-methoxynaphthalen-1-yl)methyl]butan-2-amine;hydrochloride
CID 17292334
N-[[2-(2-methoxyethoxy)naphthalen-1-yl]methyl]-2-methylpropan-1-amine
CID 63055930
N-[[2-(2-methoxyethoxy)naphthalen-1-yl]methyl]-3-phenylpropan-1-amine
CID 54804539
1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine
CID 43215559

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine?
The IUPAC name of N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine (CID 82714997) is N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine.
What is the SMILES notation for N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine?
The canonical SMILES for N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine is COCCONCc1c(OC)ccc2ccccc12.
What is the InChIKey of N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine?
The InChIKey is DEFNXDYCXXUHGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-17-9-10-19-16-11-14-13-6-4-3-5-12(13)7-8-15(14)18-2/h3-8,16H,9-11H2,1-2H3.
What are the key properties of N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine?
N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine has a molecular weight of 261.32 g/mol, XLogP of 2.52, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethoxy)-1-(2-methoxynaphthalen-1-yl)methanamine is sourced from PubChem (CID 82714997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).