[6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine

C14H15FN2O — CID 107661220

IUPAC[6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine
SMILESCc1cccc(OCc2ccc(CN)cn2)c1F
InChIInChI=1S/C14H15FN2O/c1-10-3-2-4-13(14(10)15)18-9-12-6-5-11(7-16)8-17-12/h2-6,8H,7,9,16H2,1H3
InChIKeyRAZBALVKSHWFSB-UHFFFAOYSA-N
MW246.28 g/mol
LogP2.57
Rot. Bonds4

About [6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine

[6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine (PubChem CID 107661220) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is [6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine
PubChem CID107661220
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name[6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine
SMILESCc1cccc(OCc2ccc(CN)cn2)c1F
InChIInChI=1S/C14H15FN2O/c1-10-3-2-4-13(14(10)15)18-9-12-6-5-11(7-16)8-17-12/h2-6,8H,7,9,16H2,1H3
InChIKeyRAZBALVKSHWFSB-UHFFFAOYSA-N
XLogP2.57
TPSA48.14 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 ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-fluoro-3-[(2-fluoro-3-methylphenoxy)methyl]phenyl]methanamine
CID 107656549
[5-[(2-fluoro-3-methylphenoxy)methyl]pyrazin-2-yl]hydrazine
CID 107660720
4-[(2-fluoro-3-methylphenoxy)methyl]pyridine
CID 107661921
2-[2-(2-fluoro-3-methylphenoxy)pyrimidin-5-yl]ethanamine
CID 107661759
3-(2-fluoro-3-methylphenoxy)-2-methylpropan-1-amine
CID 107659711
2-bromo-5-[(2-fluoro-3-methylphenoxy)methyl]aniline
CID 107656270
1-ethoxy-2-fluoro-3-methylbenzene
CID 59732440
5-[(2-methylphenoxy)methyl]pyridin-2-amine
CID 62195123
N-[[6-[(2-fluoro-3-methylphenoxy)methyl]-2-pyridinyl]methyl]ethanamine
CID 107661247
1,2-difluoro-3-[(2-fluoro-3-methylphenoxy)methyl]benzene
CID 107661926
[6-(2,2-difluoroethoxymethyl)-3-pyridinyl]methanamine
CID 82006174
[6-(2,3-difluorophenoxy)-5-methyl-3-pyridinyl]methanamine;hydrochloride
CID 157448294

Frequently Asked Questions

What is the IUPAC name of [6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine?
The IUPAC name of [6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine (CID 107661220) is [6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine.
What is the SMILES notation for [6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine?
The canonical SMILES for [6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine is Cc1cccc(OCc2ccc(CN)cn2)c1F.
What is the InChIKey of [6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine?
The InChIKey is RAZBALVKSHWFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-10-3-2-4-13(14(10)15)18-9-12-6-5-11(7-16)8-17-12/h2-6,8H,7,9,16H2,1H3.
What are the key properties of [6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine?
[6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine has a molecular weight of 246.28 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(2-fluoro-3-methylphenoxy)methyl]-3-pyridinyl]methanamine is sourced from PubChem (CID 107661220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).