6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine

C23H19N3O — CID 166873727

IUPAC6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine
SMILESc1ccc(COc2ccc(-c3cccc(Nc4ccncc4)n3)cc2)cc1
InChIInChI=1S/C23H19N3O/c1-2-5-18(6-3-1)17-27-21-11-9-19(10-12-21)22-7-4-8-23(26-22)25-20-13-15-24-16-14-20/h1-16H,17H2,(H,24,25,26)
InChIKeyDJFFKWVKVUEQNA-UHFFFAOYSA-N
MW353.43 g/mol
LogP5.47
Rot. Bonds6

About 6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine

6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine (PubChem CID 166873727) has the molecular formula C23H19N3O and a molecular weight of 353.43 g/mol. Its IUPAC name is 6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine.

Molecular Properties

Compound Name6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine
PubChem CID166873727
Molecular FormulaC23H19N3O
Molecular Weight353.43 g/mol
Exact Mass353.15
IUPAC Name6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine
SMILESc1ccc(COc2ccc(-c3cccc(Nc4ccncc4)n3)cc2)cc1
InChIInChI=1S/C23H19N3O/c1-2-5-18(6-3-1)17-27-21-11-9-19(10-12-21)22-7-4-8-23(26-22)25-20-13-15-24-16-14-20/h1-16H,17H2,(H,24,25,26)
InChIKeyDJFFKWVKVUEQNA-UHFFFAOYSA-N
XLogP5.47
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.43
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-fluoro-N-(4-phenylmethoxyphenyl)pyridin-2-amine
CID 130565967
N-(4-methylphenyl)-4-(4-phenylmethoxyphenyl)pyrimidin-2-amine
CID 66493776
N-hydroxy-6-(4-phenylmethoxyphenyl)pyridine-2-carboxamide
CID 87562744
N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine
CID 141029302
6-chloro-N-(4-phenylmethoxyphenyl)pyrazin-2-amine
CID 130156889
4-N-(3-fluorophenyl)-2-N-(4-phenylmethoxyphenyl)pyrimidine-2,4-diamine
CID 112906273
4-N-(3-methylphenyl)-2-N-(4-phenylmethoxyphenyl)pyrimidine-2,4-diamine
CID 112901890
6-bromo-N-(3-phenylmethoxyphenyl)pyridin-2-amine
CID 130566009
2-(4-phenylmethoxyphenyl)quinoxaline
CID 902798
2-fluoro-N-(3-phenylmethoxyphenyl)pyrimidin-4-amine
CID 164645110
2-(4-methylpiperazin-1-yl)-N-(4-phenylmethoxyphenyl)pyrimidin-4-amine
CID 112888173
N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine
CID 70645341

Frequently Asked Questions

What is the IUPAC name of 6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine?
The IUPAC name of 6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine (CID 166873727) is 6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine.
What is the SMILES notation for 6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine?
The canonical SMILES for 6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine is c1ccc(COc2ccc(-c3cccc(Nc4ccncc4)n3)cc2)cc1.
What is the InChIKey of 6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine?
The InChIKey is DJFFKWVKVUEQNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O/c1-2-5-18(6-3-1)17-27-21-11-9-19(10-12-21)22-7-4-8-23(26-22)25-20-13-15-24-16-14-20/h1-16H,17H2,(H,24,25,26).
What are the key properties of 6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine?
6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine has a molecular weight of 353.43 g/mol, XLogP of 5.47, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-phenylmethoxyphenyl)-N-pyridin-4-ylpyridin-2-amine is sourced from PubChem (CID 166873727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).