6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine

C26H27N5O — CID 130450967

IUPAC6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine
SMILESNNc1nc(N)cc(C(Cc2cccc(OCc3ccccc3)c2)c2ccccc2)c1N
InChIInChI=1S/C26H27N5O/c27-24-16-23(25(28)26(30-24)31-29)22(20-11-5-2-6-12-20)15-19-10-7-13-21(14-19)32-17-18-8-3-1-4-9-18/h1-14,16,22H,15,17,28-29H2,(H3,27,30,31)
InChIKeyZXAQAXLXXSCGEA-UHFFFAOYSA-N
MW425.54 g/mol
LogP4.49
Rot. Bonds8

About 6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine

6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine (PubChem CID 130450967) has the molecular formula C26H27N5O and a molecular weight of 425.54 g/mol. Its IUPAC name is 6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine
PubChem CID130450967
Molecular FormulaC26H27N5O
Molecular Weight425.54 g/mol
Exact Mass425.22
IUPAC Name6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine
SMILESNNc1nc(N)cc(C(Cc2cccc(OCc3ccccc3)c2)c2ccccc2)c1N
InChIInChI=1S/C26H27N5O/c27-24-16-23(25(28)26(30-24)31-29)22(20-11-5-2-6-12-20)15-19-10-7-13-21(14-19)32-17-18-8-3-1-4-9-18/h1-14,16,22H,15,17,28-29H2,(H3,27,30,31)
InChIKeyZXAQAXLXXSCGEA-UHFFFAOYSA-N
XLogP4.49
TPSA112.21 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.54
LogP ≤ 54.49
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

US10214527, Example 49
CID 126679441
3-[(4-Phenylmethoxyphenyl)diazenyl]pyridine-2,6-diamine
CID 178302486
3-[[4-[4-[(2,6-Diamino-3-pyridinyl)diazenyl]-3-methoxyphenyl]-2-methoxyphenyl]diazenyl]pyridine-2,6-diamine
CID 434796
4-[(2,6-Difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678665
4-[[3-(3-Fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678820
4-[2,2-Difluoro-1-(2-methoxyphenyl)butoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678850
4-[[2-Fluoro-5-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678862
4-[[5-(3-Fluorophenyl)-2-methylphenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678926
4-[[3-(2-Fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678935
4-[(2,3-Difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678944
6-Hydrazinyl-4-[[3-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine
CID 126679870
4-[[2-Fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126679894

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine?
The IUPAC name of 6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine (CID 130450967) is 6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine.
What is the SMILES notation for 6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine?
The canonical SMILES for 6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine is NNc1nc(N)cc(C(Cc2cccc(OCc3ccccc3)c2)c2ccccc2)c1N.
What is the InChIKey of 6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine?
The InChIKey is ZXAQAXLXXSCGEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N5O/c27-24-16-23(25(28)26(30-24)31-29)22(20-11-5-2-6-12-20)15-19-10-7-13-21(14-19)32-17-18-8-3-1-4-9-18/h1-14,16,22H,15,17,28-29H2,(H3,27,30,31).
What are the key properties of 6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine?
6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine has a molecular weight of 425.54 g/mol, XLogP of 4.49, 8 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-4-[1-phenyl-2-(3-phenylmethoxyphenyl)ethyl]pyridine-2,5-diamine is sourced from PubChem (CID 130450967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).