6-(2-phenylmethoxyphenyl)naphthalen-2-amine

C23H19NO — CID 172868680

IUPAC6-(2-phenylmethoxyphenyl)naphthalen-2-amine
SMILESNc1ccc2cc(-c3ccccc3OCc3ccccc3)ccc2c1
InChIInChI=1S/C23H19NO/c24-21-13-12-18-14-20(11-10-19(18)15-21)22-8-4-5-9-23(22)25-16-17-6-2-1-3-7-17/h1-15H,16,24H2
InChIKeyNJDNRVHCGLRXNE-UHFFFAOYSA-N
MW325.41 g/mol
LogP5.67
Rot. Bonds4

About 6-(2-phenylmethoxyphenyl)naphthalen-2-amine

6-(2-phenylmethoxyphenyl)naphthalen-2-amine (PubChem CID 172868680) has the molecular formula C23H19NO and a molecular weight of 325.41 g/mol. Its IUPAC name is 6-(2-phenylmethoxyphenyl)naphthalen-2-amine.

Molecular Properties

Compound Name6-(2-phenylmethoxyphenyl)naphthalen-2-amine
PubChem CID172868680
Molecular FormulaC23H19NO
Molecular Weight325.41 g/mol
Exact Mass325.15
IUPAC Name6-(2-phenylmethoxyphenyl)naphthalen-2-amine
SMILESNc1ccc2cc(-c3ccccc3OCc3ccccc3)ccc2c1
InChIInChI=1S/C23H19NO/c24-21-13-12-18-14-20(11-10-19(18)15-21)22-8-4-5-9-23(22)25-16-17-6-2-1-3-7-17/h1-15H,16,24H2
InChIKeyNJDNRVHCGLRXNE-UHFFFAOYSA-N
XLogP5.67
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.41
LogP ≤ 55.67
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

3-(3,4-dimethoxyphenyl)-4-phenylmethoxyaniline
CID 169408827
2-(4-aminophenyl)-6-phenylmethoxyaniline
CID 68786338
5-phenylmethoxynaphthalen-2-amine
CID 129054622
3-(2-phenylmethoxyphenyl)-5-(trifluoromethoxy)aniline
CID 166176232
2-chloro-5-(2-phenylmethoxyphenyl)phenol
CID 53221551
ethanamine;2-phenylmethoxybicyclo[3.1.0]hexa-1,3,5-triene
CID 174428998
methanol;2-phenylmethoxybicyclo[3.1.0]hexa-1,3,5-triene
CID 174530188
(1S)-1-[4-(2-phenylmethoxyphenyl)phenyl]ethanamine
CID 154814748
2-fluoro-4-(2-phenylmethoxyphenyl)benzoic acid
CID 53228660
3-fluoro-5-(2-phenylmethoxyphenyl)pyridin-2-amine
CID 175669945
2-(3-chloro-4-phenylmethoxyphenyl)aniline
CID 145161607
4-(2-fluorophenyl)-2-phenylmethoxyaniline
CID 171921752

Frequently Asked Questions

What is the IUPAC name of 6-(2-phenylmethoxyphenyl)naphthalen-2-amine?
The IUPAC name of 6-(2-phenylmethoxyphenyl)naphthalen-2-amine (CID 172868680) is 6-(2-phenylmethoxyphenyl)naphthalen-2-amine.
What is the SMILES notation for 6-(2-phenylmethoxyphenyl)naphthalen-2-amine?
The canonical SMILES for 6-(2-phenylmethoxyphenyl)naphthalen-2-amine is Nc1ccc2cc(-c3ccccc3OCc3ccccc3)ccc2c1.
What is the InChIKey of 6-(2-phenylmethoxyphenyl)naphthalen-2-amine?
The InChIKey is NJDNRVHCGLRXNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO/c24-21-13-12-18-14-20(11-10-19(18)15-21)22-8-4-5-9-23(22)25-16-17-6-2-1-3-7-17/h1-15H,16,24H2.
What are the key properties of 6-(2-phenylmethoxyphenyl)naphthalen-2-amine?
6-(2-phenylmethoxyphenyl)naphthalen-2-amine has a molecular weight of 325.41 g/mol, XLogP of 5.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-phenylmethoxyphenyl)naphthalen-2-amine is sourced from PubChem (CID 172868680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).