5-phenylmethoxynaphthalen-2-amine

C17H15NO — CID 129054622

IUPAC5-phenylmethoxynaphthalen-2-amine
SMILESNc1ccc2c(OCc3ccccc3)cccc2c1
InChIInChI=1S/C17H15NO/c18-15-9-10-16-14(11-15)7-4-8-17(16)19-12-13-5-2-1-3-6-13/h1-11H,12,18H2
InChIKeyORVQNTUZMZEHCD-UHFFFAOYSA-N
MW249.31 g/mol
LogP4.00
Rot. Bonds3

About 5-phenylmethoxynaphthalen-2-amine

5-phenylmethoxynaphthalen-2-amine (PubChem CID 129054622) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is 5-phenylmethoxynaphthalen-2-amine.

Molecular Properties

Compound Name5-phenylmethoxynaphthalen-2-amine
PubChem CID129054622
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name5-phenylmethoxynaphthalen-2-amine
SMILESNc1ccc2c(OCc3ccccc3)cccc2c1
InChIInChI=1S/C17H15NO/c18-15-9-10-16-14(11-15)7-4-8-17(16)19-12-13-5-2-1-3-6-13/h1-11H,12,18H2
InChIKeyORVQNTUZMZEHCD-UHFFFAOYSA-N
XLogP4.00
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-phenylmethoxynaphthalen-2-ol
CID 71348952
1-phenylmethoxy-6-[2-[2-[2-[2-(5-phenylmethoxynaphthalen-2-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]naphthalene
CID 10794421
5-phenoxynaphthalen-2-amine
CID 138739792
6-(2-phenylmethoxyphenyl)naphthalen-2-amine
CID 172868680
7-fluoro-1-phenylmethoxynaphthalene
CID 154464455
3-iodo-4-phenylmethoxyaniline;iron
CID 70281064
3-methoxy-4-phenylmethoxyaniline
CID 27226
1-(naphthalen-2-ylmethoxy)naphthalene
CID 132511538
8-phenylmethoxyquinolin-6-amine
CID 22053377
2,3,6,7,10,11-hexakis(phenylmethoxy)triphenylene
CID 11040205
1,2-bis(phenylmethoxy)naphthalene
CID 67710722
2-(4-aminophenyl)-6-phenylmethoxyaniline
CID 68786338

Frequently Asked Questions

What is the IUPAC name of 5-phenylmethoxynaphthalen-2-amine?
The IUPAC name of 5-phenylmethoxynaphthalen-2-amine (CID 129054622) is 5-phenylmethoxynaphthalen-2-amine.
What is the SMILES notation for 5-phenylmethoxynaphthalen-2-amine?
The canonical SMILES for 5-phenylmethoxynaphthalen-2-amine is Nc1ccc2c(OCc3ccccc3)cccc2c1.
What is the InChIKey of 5-phenylmethoxynaphthalen-2-amine?
The InChIKey is ORVQNTUZMZEHCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c18-15-9-10-16-14(11-15)7-4-8-17(16)19-12-13-5-2-1-3-6-13/h1-11H,12,18H2.
What are the key properties of 5-phenylmethoxynaphthalen-2-amine?
5-phenylmethoxynaphthalen-2-amine has a molecular weight of 249.31 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenylmethoxynaphthalen-2-amine is sourced from PubChem (CID 129054622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).