2-(2-phenylmethoxynaphthalen-1-yl)ethanamine

C19H19NO — CID 60905443

IUPAC2-(2-phenylmethoxynaphthalen-1-yl)ethanamine
SMILESNCCc1c(OCc2ccccc2)ccc2ccccc12
InChIInChI=1S/C19H19NO/c20-13-12-18-17-9-5-4-8-16(17)10-11-19(18)21-14-15-6-2-1-3-7-15/h1-11H,12-14,20H2
InChIKeyLRQYZXPSZWLBAV-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.92
Rot. Bonds5

About 2-(2-phenylmethoxynaphthalen-1-yl)ethanamine

2-(2-phenylmethoxynaphthalen-1-yl)ethanamine (PubChem CID 60905443) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-(2-phenylmethoxynaphthalen-1-yl)ethanamine.

Molecular Properties

Compound Name2-(2-phenylmethoxynaphthalen-1-yl)ethanamine
PubChem CID60905443
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name2-(2-phenylmethoxynaphthalen-1-yl)ethanamine
SMILESNCCc1c(OCc2ccccc2)ccc2ccccc12
InChIInChI=1S/C19H19NO/c20-13-12-18-17-9-5-4-8-16(17)10-11-19(18)21-14-15-6-2-1-3-7-15/h1-11H,12-14,20H2
InChIKeyLRQYZXPSZWLBAV-UHFFFAOYSA-N
XLogP3.92
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylmethoxynaphthalen-1-yl)ethanamine?
The IUPAC name of 2-(2-phenylmethoxynaphthalen-1-yl)ethanamine (CID 60905443) is 2-(2-phenylmethoxynaphthalen-1-yl)ethanamine.
What is the SMILES notation for 2-(2-phenylmethoxynaphthalen-1-yl)ethanamine?
The canonical SMILES for 2-(2-phenylmethoxynaphthalen-1-yl)ethanamine is NCCc1c(OCc2ccccc2)ccc2ccccc12.
What is the InChIKey of 2-(2-phenylmethoxynaphthalen-1-yl)ethanamine?
The InChIKey is LRQYZXPSZWLBAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c20-13-12-18-17-9-5-4-8-16(17)10-11-19(18)21-14-15-6-2-1-3-7-15/h1-11H,12-14,20H2.
What are the key properties of 2-(2-phenylmethoxynaphthalen-1-yl)ethanamine?
2-(2-phenylmethoxynaphthalen-1-yl)ethanamine has a molecular weight of 277.37 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylmethoxynaphthalen-1-yl)ethanamine is sourced from PubChem (CID 60905443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).