4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine

C19H17FN2O — CID 70663307

IUPAC4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine
SMILESCNc1cnccc1-c1ccc(F)cc1OCc1ccccc1
InChIInChI=1S/C19H17FN2O/c1-21-18-12-22-10-9-16(18)17-8-7-15(20)11-19(17)23-13-14-5-3-2-4-6-14/h2-12,21H,13H2,1H3
InChIKeyQOYLYUQCVJFHMI-UHFFFAOYSA-N
MW308.36 g/mol
LogP4.51
Rot. Bonds5

About 4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine

4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine (PubChem CID 70663307) has the molecular formula C19H17FN2O and a molecular weight of 308.36 g/mol. Its IUPAC name is 4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine.

Molecular Properties

Compound Name4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine
PubChem CID70663307
Molecular FormulaC19H17FN2O
Molecular Weight308.36 g/mol
Exact Mass308.13
IUPAC Name4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine
SMILESCNc1cnccc1-c1ccc(F)cc1OCc1ccccc1
InChIInChI=1S/C19H17FN2O/c1-21-18-12-22-10-9-16(18)17-8-7-15(20)11-19(17)23-13-14-5-3-2-4-6-14/h2-12,21H,13H2,1H3
InChIKeyQOYLYUQCVJFHMI-UHFFFAOYSA-N
XLogP4.51
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine?
The IUPAC name of 4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine (CID 70663307) is 4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine.
What is the SMILES notation for 4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine?
The canonical SMILES for 4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine is CNc1cnccc1-c1ccc(F)cc1OCc1ccccc1.
What is the InChIKey of 4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine?
The InChIKey is QOYLYUQCVJFHMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O/c1-21-18-12-22-10-9-16(18)17-8-7-15(20)11-19(17)23-13-14-5-3-2-4-6-14/h2-12,21H,13H2,1H3.
What are the key properties of 4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine?
4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine has a molecular weight of 308.36 g/mol, XLogP of 4.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluoro-2-phenylmethoxyphenyl)-N-methylpyridin-3-amine is sourced from PubChem (CID 70663307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).