2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine

C16H20F2N2O2 — CID 158118535

IUPAC2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine
SMILESCNC.COc1ccccc1OCc1ccc(C(F)F)nc1
InChIInChI=1S/C14H13F2NO2.C2H7N/c1-18-12-4-2-3-5-13(12)19-9-10-6-7-11(14(15)16)17-8-10;1-3-2/h2-8,14H,9H2,1H3;3H,1-2H3
InChIKeyFRIAGLLAPJSBDQ-UHFFFAOYSA-N
MW310.34 g/mol
LogP3.44
Rot. Bonds5

About 2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine

2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine (PubChem CID 158118535) has the molecular formula C16H20F2N2O2 and a molecular weight of 310.34 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine.

Molecular Properties

Compound Name2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine
PubChem CID158118535
Molecular FormulaC16H20F2N2O2
Molecular Weight310.34 g/mol
Exact Mass310.15
IUPAC Name2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine
SMILESCNC.COc1ccccc1OCc1ccc(C(F)F)nc1
InChIInChI=1S/C14H13F2NO2.C2H7N/c1-18-12-4-2-3-5-13(12)19-9-10-6-7-11(14(15)16)17-8-10;1-3-2/h2-8,14H,9H2,1H3;3H,1-2H3
InChIKeyFRIAGLLAPJSBDQ-UHFFFAOYSA-N
XLogP3.44
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.34
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene
CID 957472
5-[(2-methoxyphenoxy)methyl]pyridine-2-carboxylic acid
CID 117213246
1-iodo-4-[(2-methoxyphenoxy)methyl]benzene
CID 65490532
1-methoxy-2-[(4-phenylphenyl)methoxy]benzene
CID 67858860
2-(difluoromethyl)-5-[[4-(imidazol-1-ylmethyl)-5-iodo-2-methoxyphenoxy]methyl]pyridine
CID 118141898
2-methoxy-4-[(2-methoxyphenoxy)methyl]phenol
CID 71421092
3-bromo-5-[(2-methoxyphenoxy)methyl]pyridine
CID 115580496
13-(difluoromethyl)-4-[4-[(2-methoxyphenoxy)methyl]phenyl]-11-methyl-16-thia-3,5,6,8,14-pentazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),2,4,7,10(15),11,13-heptaene
CID 19590173
5-[(2-chlorophenoxy)methyl]-N-methylpyridin-2-amine
CID 55044923
(1S)-1-[2-[(3,4-dimethoxyphenyl)methoxy]phenyl]ethanol
CID 63364724
1-[3-methoxy-4-(pyridin-3-ylmethoxy)phenyl]-N-methylmethanamine
CID 43278584
N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine
CID 62194578

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine?
The IUPAC name of 2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine (CID 158118535) is 2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine.
What is the SMILES notation for 2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine?
The canonical SMILES for 2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine is CNC.COc1ccccc1OCc1ccc(C(F)F)nc1.
What is the InChIKey of 2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine?
The InChIKey is FRIAGLLAPJSBDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2NO2.C2H7N/c1-18-12-4-2-3-5-13(12)19-9-10-6-7-11(14(15)16)17-8-10;1-3-2/h2-8,14H,9H2,1H3;3H,1-2H3.
What are the key properties of 2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine?
2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine has a molecular weight of 310.34 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-[(2-methoxyphenoxy)methyl]pyridine;N-methylmethanamine is sourced from PubChem (CID 158118535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).