1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine

C16H19NO — CID 63912716

IUPAC1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine
SMILESCNC(COc1cccc2ccccc12)C1CC1
InChIInChI=1S/C16H19NO/c1-17-15(13-9-10-13)11-18-16-8-4-6-12-5-2-3-7-14(12)16/h2-8,13,15,17H,9-11H2,1H3
InChIKeyLIVGKTJRJCVOTB-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.22
Rot. Bonds5

About 1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine

1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine (PubChem CID 63912716) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine
PubChem CID63912716
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine
SMILESCNC(COc1cccc2ccccc12)C1CC1
InChIInChI=1S/C16H19NO/c1-17-15(13-9-10-13)11-18-16-8-4-6-12-5-2-3-7-14(12)16/h2-8,13,15,17H,9-11H2,1H3
InChIKeyLIVGKTJRJCVOTB-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine?
The IUPAC name of 1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine (CID 63912716) is 1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine.
What is the SMILES notation for 1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine?
The canonical SMILES for 1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine is CNC(COc1cccc2ccccc12)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine?
The InChIKey is LIVGKTJRJCVOTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-17-15(13-9-10-13)11-18-16-8-4-6-12-5-2-3-7-14(12)16/h2-8,13,15,17H,9-11H2,1H3.
What are the key properties of 1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine?
1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine has a molecular weight of 241.33 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-methyl-2-naphthalen-1-yloxyethanamine is sourced from PubChem (CID 63912716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).