6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine

C22H24N6 — CID 123152845

IUPAC6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine
SMILESNc1ccc(C2=CCN(N)C(C3=CC(c4ccc(N)cc4)=CCN3N)=C2)cc1
InChIInChI=1S/C22H24N6/c23-19-5-1-15(2-6-19)17-9-11-27(25)21(13-17)22-14-18(10-12-28(22)26)16-3-7-20(24)8-4-16/h1-10,13-14H,11-12,23-26H2
InChIKeyJUYYYMNGDGIWKO-UHFFFAOYSA-N
MW372.48 g/mol
LogP2.46
Rot. Bonds3

About 6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine

6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine (PubChem CID 123152845) has the molecular formula C22H24N6 and a molecular weight of 372.48 g/mol. Its IUPAC name is 6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine.

Molecular Properties

Compound Name6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine
PubChem CID123152845
Molecular FormulaC22H24N6
Molecular Weight372.48 g/mol
Exact Mass372.21
IUPAC Name6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine
SMILESNc1ccc(C2=CCN(N)C(C3=CC(c4ccc(N)cc4)=CCN3N)=C2)cc1
InChIInChI=1S/C22H24N6/c23-19-5-1-15(2-6-19)17-9-11-27(25)21(13-17)22-14-18(10-12-28(22)26)16-3-7-20(24)8-4-16/h1-10,13-14H,11-12,23-26H2
InChIKeyJUYYYMNGDGIWKO-UHFFFAOYSA-N
XLogP2.46
TPSA110.56 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.48
LogP ≤ 52.46
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine?
The IUPAC name of 6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine (CID 123152845) is 6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine.
What is the SMILES notation for 6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine?
The canonical SMILES for 6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine is Nc1ccc(C2=CCN(N)C(C3=CC(c4ccc(N)cc4)=CCN3N)=C2)cc1.
What is the InChIKey of 6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine?
The InChIKey is JUYYYMNGDGIWKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N6/c23-19-5-1-15(2-6-19)17-9-11-27(25)21(13-17)22-14-18(10-12-28(22)26)16-3-7-20(24)8-4-16/h1-10,13-14H,11-12,23-26H2.
What are the key properties of 6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine?
6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine has a molecular weight of 372.48 g/mol, XLogP of 2.46, 3 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-amino-4-(4-aminophenyl)-2H-pyridin-6-yl]-4-(4-aminophenyl)-2H-pyridin-1-amine is sourced from PubChem (CID 123152845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).