4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol

C24H21N3O2 — CID 137136041

IUPAC4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol
SMILESCOc1cc(-c2cc(-c3ccc(N)cc3)nc(-c3ccc(N)cc3)c2)ccc1O
InChIInChI=1S/C24H21N3O2/c1-29-24-14-17(6-11-23(24)28)18-12-21(15-2-7-19(25)8-3-15)27-22(13-18)16-4-9-20(26)10-5-16/h2-14,28H,25-26H2,1H3
InChIKeyFOGUFJHFAZZMAX-UHFFFAOYSA-N
MW383.45 g/mol
LogP4.96
Rot. Bonds4

About 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol

4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol (PubChem CID 137136041) has the molecular formula C24H21N3O2 and a molecular weight of 383.45 g/mol. Its IUPAC name is 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol.

Molecular Properties

Compound Name4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol
PubChem CID137136041
Molecular FormulaC24H21N3O2
Molecular Weight383.45 g/mol
Exact Mass383.16
IUPAC Name4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol
SMILESCOc1cc(-c2cc(-c3ccc(N)cc3)nc(-c3ccc(N)cc3)c2)ccc1O
InChIInChI=1S/C24H21N3O2/c1-29-24-14-17(6-11-23(24)28)18-12-21(15-2-7-19(25)8-3-15)27-22(13-18)16-4-9-20(26)10-5-16/h2-14,28H,25-26H2,1H3
InChIKeyFOGUFJHFAZZMAX-UHFFFAOYSA-N
XLogP4.96
TPSA94.39 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 54.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-(3,5-dimethylphenyl)-2-methoxyphenol
CID 53220752
4-[2,6-bis(4-aminophenyl)-4-pyridinyl]aniline
CID 86022231
6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol
CID 56648216
2-amino-5-(4-amino-3-methoxyphenyl)phenol
CID 131862396
2-amino-4-[6-(dimethylamino)-3-pyridinyl]-6-(4-hydroxy-3-methoxyphenyl)pyridine-3-carbonitrile
CID 135990769
4-(4-fluoro-3-methylphenyl)-2-methoxyphenol
CID 53220783
4-[3-(4-hydroxy-3-methoxyphenyl)benzo[g]quinoxalin-2-yl]-2-methoxyphenol
CID 1309066
4-(6-iodoimidazo[1,2-a]pyridin-2-yl)-2-methoxyphenol
CID 68719321
2-methoxy-4-(4-methylsulfonylphenyl)phenol
CID 53221054
2-amino-4-(4-hydroxy-3-methoxyphenyl)-5,6-dimethylpyridine-3-carbonitrile
CID 856296
2-amino-4-(3,4-dimethoxyphenyl)-6-(4-hydroxyphenyl)pyridine-3-carbonitrile
CID 856280
4-[5-[(1R)-1-aminoethyl]-1,2,4-oxadiazol-3-yl]-2-methoxyphenol
CID 136969288

Frequently Asked Questions

What is the IUPAC name of 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol?
The IUPAC name of 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol (CID 137136041) is 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol.
What is the SMILES notation for 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol?
The canonical SMILES for 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol is COc1cc(-c2cc(-c3ccc(N)cc3)nc(-c3ccc(N)cc3)c2)ccc1O.
What is the InChIKey of 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol?
The InChIKey is FOGUFJHFAZZMAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O2/c1-29-24-14-17(6-11-23(24)28)18-12-21(15-2-7-19(25)8-3-15)27-22(13-18)16-4-9-20(26)10-5-16/h2-14,28H,25-26H2,1H3.
What are the key properties of 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol?
4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol has a molecular weight of 383.45 g/mol, XLogP of 4.96, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,6-bis(4-aminophenyl)-4-pyridinyl]-2-methoxyphenol is sourced from PubChem (CID 137136041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).