3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine

C13H13FN2O — CID 114345632

IUPAC3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine
SMILESCc1cc(F)ccc1COc1cccnc1N
InChIInChI=1S/C13H13FN2O/c1-9-7-11(14)5-4-10(9)8-17-12-3-2-6-16-13(12)15/h2-7H,8H2,1H3,(H2,15,16)
InChIKeyIELPRQXICYLXEF-UHFFFAOYSA-N
MW232.26 g/mol
LogP2.69
Rot. Bonds3

About 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine

3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine (PubChem CID 114345632) has the molecular formula C13H13FN2O and a molecular weight of 232.26 g/mol. Its IUPAC name is 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine.

Molecular Properties

Compound Name3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine
PubChem CID114345632
Molecular FormulaC13H13FN2O
Molecular Weight232.26 g/mol
Exact Mass232.10
IUPAC Name3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine
SMILESCc1cc(F)ccc1COc1cccnc1N
InChIInChI=1S/C13H13FN2O/c1-9-7-11(14)5-4-10(9)8-17-12-3-2-6-16-13(12)15/h2-7H,8H2,1H3,(H2,15,16)
InChIKeyIELPRQXICYLXEF-UHFFFAOYSA-N
XLogP2.69
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_C(3)', 'substructure': 'N/A'}

Analyze 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine 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

4-[(2-amino-3-pyridinyl)oxymethyl]-3-methylbenzonitrile
CID 114478972
3-[(4-bromo-2-fluorophenyl)methoxy]pyridin-2-amine
CID 43438660
3-[(4-fluoro-2-methylphenyl)methoxy]-2-methylphenol
CID 114346383
1-[2-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanamine
CID 114345723
5-bromo-4-fluoro-2-[(4-fluoro-2-methylphenyl)methoxy]aniline
CID 103483039
2-amino-6-[(4-fluoro-2-methylphenyl)methoxy]benzoic acid
CID 107341632
3-[(3,4-difluorophenyl)methoxy]pyridin-2-amine
CID 10331655
3-[(2,4-difluorophenyl)methoxy]-6-methylpyridin-2-amine
CID 62197636
8-[(5-fluoro-2-methylphenyl)methoxy]quinolin-5-amine
CID 105369730
5-amino-2-[(4-fluoro-2-methylphenyl)methoxy]benzonitrile
CID 114345639
3-[(2-fluorophenoxy)methyl]pyridin-2-amine
CID 62464415
4-amino-2-[(4-fluoro-2-methylphenyl)methoxy]benzamide
CID 106955505

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine?
The IUPAC name of 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine (CID 114345632) is 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine.
What is the SMILES notation for 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine?
The canonical SMILES for 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine is Cc1cc(F)ccc1COc1cccnc1N.
What is the InChIKey of 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine?
The InChIKey is IELPRQXICYLXEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O/c1-9-7-11(14)5-4-10(9)8-17-12-3-2-6-16-13(12)15/h2-7H,8H2,1H3,(H2,15,16).
What are the key properties of 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine?
3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine has a molecular weight of 232.26 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluoro-2-methylphenyl)methoxy]pyridin-2-amine is sourced from PubChem (CID 114345632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).