N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine

C17H15N3O — CID 173139958

IUPACN-[4-(3-aminophenoxy)phenyl]pyridin-2-amine
SMILESNc1cccc(Oc2ccc(Nc3ccccn3)cc2)c1
InChIInChI=1S/C17H15N3O/c18-13-4-3-5-16(12-13)21-15-9-7-14(8-10-15)20-17-6-1-2-11-19-17/h1-12H,18H2,(H,19,20)
InChIKeyLTHQVARSAICWLM-UHFFFAOYSA-N
MW277.33 g/mol
LogP4.20
Rot. Bonds4

About N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine

N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine (PubChem CID 173139958) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[4-(3-aminophenoxy)phenyl]pyridin-2-amine
PubChem CID173139958
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC NameN-[4-(3-aminophenoxy)phenyl]pyridin-2-amine
SMILESNc1cccc(Oc2ccc(Nc3ccccn3)cc2)c1
InChIInChI=1S/C17H15N3O/c18-13-4-3-5-16(12-13)21-15-9-7-14(8-10-15)20-17-6-1-2-11-19-17/h1-12H,18H2,(H,19,20)
InChIKeyLTHQVARSAICWLM-UHFFFAOYSA-N
XLogP4.20
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 54.20
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

1-N,4-N-dipyridin-2-ylbenzene-1,4-diamine
CID 139175237
N-(4-pyrazin-2-yloxyphenyl)pyridin-2-amine
CID 59374194
3-[3-[4-[4-[4-[4-[3-(3-aminophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]aniline
CID 22338635
3-[4-(4-aminophenoxy)phenoxy]aniline
CID 22184043
3-(3-phenoxyphenoxy)aniline
CID 68727404
2-(3-aminophenyl)-4-N-(4-phenoxyphenyl)pyrimidine-4,6-diamine
CID 66769396
3-[4-[4-[2-[2-[4-[4-(3-aminophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]aniline
CID 22338441
3-[2-[4-[3-[2-[3-[4-[2-(3-aminophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]phenoxy]aniline
CID 22338477
3-[4-[2-[2-[4-(3-aminophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]aniline
CID 22338564
6-N-(4-phenoxyphenyl)-8-N-pyridin-2-yl-7H-purine-6,8-diamine
CID 117092787
3-[3,5-bis(3-aminophenoxy)phenoxy]aniline
CID 19698881
4-N-(4-methyl-2-pyridinyl)-6-N-(4-phenoxyphenyl)pyrimidine-4,5,6-triamine
CID 22545280

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine?
The IUPAC name of N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine (CID 173139958) is N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine.
What is the SMILES notation for N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine?
The canonical SMILES for N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine is Nc1cccc(Oc2ccc(Nc3ccccn3)cc2)c1.
What is the InChIKey of N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine?
The InChIKey is LTHQVARSAICWLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c18-13-4-3-5-16(12-13)21-15-9-7-14(8-10-15)20-17-6-1-2-11-19-17/h1-12H,18H2,(H,19,20).
What are the key properties of N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine?
N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine has a molecular weight of 277.33 g/mol, XLogP of 4.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-aminophenoxy)phenyl]pyridin-2-amine is sourced from PubChem (CID 173139958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).