(4-aminophenoxy)methanediazonium

C7H8N3O+ — CID 154269216

IUPAC(4-aminophenoxy)methanediazonium
SMILESN#[N+]COc1ccc(N)cc1
InChIInChI=1S/C7H8N3O/c8-6-1-3-7(4-2-6)11-5-10-9/h1-4H,5,8H2/q+1
InChIKeySGDPNXUHAPTFNC-UHFFFAOYSA-N
MW150.16 g/mol
LogP1.46
Rot. Bonds2

About (4-aminophenoxy)methanediazonium

(4-aminophenoxy)methanediazonium (PubChem CID 154269216) has the molecular formula C7H8N3O+ and a molecular weight of 150.16 g/mol. Its IUPAC name is (4-aminophenoxy)methanediazonium.

Molecular Properties

Compound Name(4-aminophenoxy)methanediazonium
PubChem CID154269216
Molecular FormulaC7H8N3O+
Molecular Weight150.16 g/mol
Exact Mass150.07
IUPAC Name(4-aminophenoxy)methanediazonium
SMILESN#[N+]COc1ccc(N)cc1
InChIInChI=1S/C7H8N3O/c8-6-1-3-7(4-2-6)11-5-10-9/h1-4H,5,8H2/q+1
InChIKeySGDPNXUHAPTFNC-UHFFFAOYSA-N
XLogP1.46
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.16
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Azo_group', 'substructure': 'N/A'}

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Related Compounds

4-[19-(4-aminophenoxy)nonadecoxy]aniline
CID 139902778
4-[2-[4-[2-(4-aminophenoxy)ethoxy]phenoxy]ethoxy]aniline;azane
CID 67942387
4-[4-(dimethylamino)butoxy]aniline
CID 11458449
4-[(E)-4-(4-aminophenoxy)but-2-enoxy]aniline
CID 23321989
4-[4-[4-[2-(4-aminophenoxy)ethoxy]phenyl]phenyl]aniline
CID 145159211
1,2-bis(4-aminophenoxy)ethane-1,1-diamine
CID 141003023
2-[10-(4-aminophenoxy)decoxy]aniline
CID 146356244
4-(azidomethoxy)aniline
CID 152728355
4-[5-(4-phenylphenoxy)pentoxy]aniline
CID 24833731
4-(4-aminophenoxy)aniline
CID 161415647
4-[3-(4-aminophenoxy)propyl]aniline
CID 146744980
4-phenylmethoxyaniline
CID 159966727

Frequently Asked Questions

What is the IUPAC name of (4-aminophenoxy)methanediazonium?
The IUPAC name of (4-aminophenoxy)methanediazonium (CID 154269216) is (4-aminophenoxy)methanediazonium.
What is the SMILES notation for (4-aminophenoxy)methanediazonium?
The canonical SMILES for (4-aminophenoxy)methanediazonium is N#[N+]COc1ccc(N)cc1.
What is the InChIKey of (4-aminophenoxy)methanediazonium?
The InChIKey is SGDPNXUHAPTFNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N3O/c8-6-1-3-7(4-2-6)11-5-10-9/h1-4H,5,8H2/q+1.
What are the key properties of (4-aminophenoxy)methanediazonium?
(4-aminophenoxy)methanediazonium has a molecular weight of 150.16 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminophenoxy)methanediazonium is sourced from PubChem (CID 154269216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).