2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline

C14H15FN2O — CID 75482762

IUPAC2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline
SMILESCOc1ccc(F)c(NCc2cccnc2C)c1
InChIInChI=1S/C14H15FN2O/c1-10-11(4-3-7-16-10)9-17-14-8-12(18-2)5-6-13(14)15/h3-8,17H,9H2,1-2H3
InChIKeyNRGDSFYLVRWZAD-UHFFFAOYSA-N
MW246.28 g/mol
LogP3.15
Rot. Bonds4

About 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline

2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline (PubChem CID 75482762) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline.

Molecular Properties

Compound Name2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline
PubChem CID75482762
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline
SMILESCOc1ccc(F)c(NCc2cccnc2C)c1
InChIInChI=1S/C14H15FN2O/c1-10-11(4-3-7-16-10)9-17-14-8-12(18-2)5-6-13(14)15/h3-8,17H,9H2,1-2H3
InChIKeyNRGDSFYLVRWZAD-UHFFFAOYSA-N
XLogP3.15
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-4-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-2-methylaniline
CID 107591882
5-chloro-2-fluoro-N-[(2-fluoro-4-methoxyphenyl)methyl]aniline
CID 102876267
2-fluoro-5-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]aniline
CID 107914730
N-[(4-chloro-2-fluorophenyl)methyl]-2-methylpyridin-3-amine
CID 114842458
2-fluoro-5-methoxy-N-[(4-phenylmethoxyphenyl)methyl]aniline
CID 113253994
3-(2-fluoro-4-methoxyphenyl)-2-methylpyridine
CID 118448916
5-methoxy-N-[(2-methoxy-3-pyridinyl)methyl]-2-nitroaniline
CID 79034228
N-[(2-fluoro-4-methoxyphenyl)methyl]-1-(2-methoxy-3-pyridinyl)methanamine
CID 102876282
N-[(2-bromo-5-methoxyphenyl)methyl]-2,5-difluoro-4-methylaniline
CID 103585589
2-fluoro-5-methoxy-N-[(2-methyltetrazol-5-yl)methyl]aniline
CID 107042537
2-fluoro-N-[(4-methoxyphenyl)methyl]-5-methylaniline
CID 28968417
2-fluoro-N-[(3-methoxyphenyl)methyl]-5-methylaniline
CID 28879448

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline?
The IUPAC name of 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline (CID 75482762) is 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline.
What is the SMILES notation for 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline?
The canonical SMILES for 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline is COc1ccc(F)c(NCc2cccnc2C)c1.
What is the InChIKey of 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline?
The InChIKey is NRGDSFYLVRWZAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-10-11(4-3-7-16-10)9-17-14-8-12(18-2)5-6-13(14)15/h3-8,17H,9H2,1-2H3.
What are the key properties of 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline?
2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline has a molecular weight of 246.28 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-methoxy-N-[(2-methyl-3-pyridinyl)methyl]aniline is sourced from PubChem (CID 75482762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).