3-[2-(3-aminophenoxy)phenoxy]aniline

C18H16N2O2 — CID 22184040

IUPAC3-[2-(3-aminophenoxy)phenoxy]aniline
SMILESNc1cccc(Oc2ccccc2Oc2cccc(N)c2)c1
InChIInChI=1S/C18H16N2O2/c19-13-5-3-7-15(11-13)21-17-9-1-2-10-18(17)22-16-8-4-6-14(20)12-16/h1-12H,19-20H2
InChIKeyBZXJAHGHOJFYRT-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.44
Rot. Bonds4

About 3-[2-(3-aminophenoxy)phenoxy]aniline

3-[2-(3-aminophenoxy)phenoxy]aniline (PubChem CID 22184040) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 3-[2-(3-aminophenoxy)phenoxy]aniline.

Molecular Properties

Compound Name3-[2-(3-aminophenoxy)phenoxy]aniline
PubChem CID22184040
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name3-[2-(3-aminophenoxy)phenoxy]aniline
SMILESNc1cccc(Oc2ccccc2Oc2cccc(N)c2)c1
InChIInChI=1S/C18H16N2O2/c19-13-5-3-7-15(11-13)21-17-9-1-2-10-18(17)22-16-8-4-6-14(20)12-16/h1-12H,19-20H2
InChIKeyBZXJAHGHOJFYRT-UHFFFAOYSA-N
XLogP4.44
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[4-[2-[2-[4-(3-aminophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]aniline
CID 22338564
3-[2-(3-phenoxyphenoxy)phenoxy]aniline
CID 141038666
3-[2-[4-[3-[2-[3-[4-[2-(3-aminophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]aniline
CID 22338477
3-[4-[4-[2-[2-[4-[4-(3-aminophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]aniline
CID 22338441
3-[4-(3-aminophenoxy)naphthalen-1-yl]oxyaniline
CID 66887751
3-(3-phenoxyphenoxy)aniline
CID 68727404
3-[2-[2-[2-(3-aminophenoxy)phenyl]propan-2-yl]phenoxy]aniline
CID 22483776
3-[3,5-bis(3-aminophenoxy)phenoxy]aniline
CID 19698881
3-[3-[3-[3-[3-(3-aminophenoxy)phenoxy]-2-chlorophenoxy]-2-chlorophenoxy]phenoxy]aniline
CID 22338531
3-[3-(4-aminophenoxy)-2-iodophenoxy]aniline
CID 118976058
3-(2,4-difluorophenoxy)aniline
CID 71424948
2,6-bis(3-aminophenoxy)benzoic acid
CID 154115522

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-aminophenoxy)phenoxy]aniline?
The IUPAC name of 3-[2-(3-aminophenoxy)phenoxy]aniline (CID 22184040) is 3-[2-(3-aminophenoxy)phenoxy]aniline.
What is the SMILES notation for 3-[2-(3-aminophenoxy)phenoxy]aniline?
The canonical SMILES for 3-[2-(3-aminophenoxy)phenoxy]aniline is Nc1cccc(Oc2ccccc2Oc2cccc(N)c2)c1.
What is the InChIKey of 3-[2-(3-aminophenoxy)phenoxy]aniline?
The InChIKey is BZXJAHGHOJFYRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c19-13-5-3-7-15(11-13)21-17-9-1-2-10-18(17)22-16-8-4-6-14(20)12-16/h1-12H,19-20H2.
What are the key properties of 3-[2-(3-aminophenoxy)phenoxy]aniline?
3-[2-(3-aminophenoxy)phenoxy]aniline has a molecular weight of 292.34 g/mol, XLogP of 4.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-aminophenoxy)phenoxy]aniline is sourced from PubChem (CID 22184040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).