N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine

C14H21NO — CID 59535616

IUPACN-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCOCCNC1CCc2cc(C)ccc2C1
InChIInChI=1S/C14H21NO/c1-11-3-4-13-10-14(15-7-8-16-2)6-5-12(13)9-11/h3-4,9,14-15H,5-8,10H2,1-2H3
InChIKeyVZZAIQJVMZUCDX-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.09
Rot. Bonds4

About N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine

N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 59535616) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID59535616
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCOCCNC1CCc2cc(C)ccc2C1
InChIInChI=1S/C14H21NO/c1-11-3-4-13-10-14(15-7-8-16-2)6-5-12(13)9-11/h3-4,9,14-15H,5-8,10H2,1-2H3
InChIKeyVZZAIQJVMZUCDX-UHFFFAOYSA-N
XLogP2.09
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 59535616) is N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine is COCCNC1CCc2cc(C)ccc2C1.
What is the InChIKey of N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is VZZAIQJVMZUCDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11-3-4-13-10-14(15-7-8-16-2)6-5-12(13)9-11/h3-4,9,14-15H,5-8,10H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 219.33 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 59535616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).