2-naphthalen-2-yloxy-1-phenylethanamine

C18H17NO — CID 16794877

IUPAC2-naphthalen-2-yloxy-1-phenylethanamine
SMILESNC(COc1ccc2ccccc2c1)c1ccccc1
InChIInChI=1S/C18H17NO/c19-18(15-7-2-1-3-8-15)13-20-17-11-10-14-6-4-5-9-16(14)12-17/h1-12,18H,13,19H2
InChIKeySNWKUJWOUCHSBN-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.92
Rot. Bonds4

About 2-naphthalen-2-yloxy-1-phenylethanamine

2-naphthalen-2-yloxy-1-phenylethanamine (PubChem CID 16794877) has the molecular formula C18H17NO and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-1-phenylethanamine.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-1-phenylethanamine
PubChem CID16794877
Molecular FormulaC18H17NO
Molecular Weight263.34 g/mol
Exact Mass263.13
IUPAC Name2-naphthalen-2-yloxy-1-phenylethanamine
SMILESNC(COc1ccc2ccccc2c1)c1ccccc1
InChIInChI=1S/C18H17NO/c19-18(15-7-2-1-3-8-15)13-20-17-11-10-14-6-4-5-9-16(14)12-17/h1-12,18H,13,19H2
InChIKeySNWKUJWOUCHSBN-UHFFFAOYSA-N
XLogP3.92
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
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-naphthalen-2-yloxy-1-phenylethanamine?
The IUPAC name of 2-naphthalen-2-yloxy-1-phenylethanamine (CID 16794877) is 2-naphthalen-2-yloxy-1-phenylethanamine.
What is the SMILES notation for 2-naphthalen-2-yloxy-1-phenylethanamine?
The canonical SMILES for 2-naphthalen-2-yloxy-1-phenylethanamine is NC(COc1ccc2ccccc2c1)c1ccccc1.
What is the InChIKey of 2-naphthalen-2-yloxy-1-phenylethanamine?
The InChIKey is SNWKUJWOUCHSBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO/c19-18(15-7-2-1-3-8-15)13-20-17-11-10-14-6-4-5-9-16(14)12-17/h1-12,18H,13,19H2.
What are the key properties of 2-naphthalen-2-yloxy-1-phenylethanamine?
2-naphthalen-2-yloxy-1-phenylethanamine has a molecular weight of 263.34 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-1-phenylethanamine is sourced from PubChem (CID 16794877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).