methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate

C16H13FN2O3 — CID 117256129

IUPACmethyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate
SMILESCOC(=O)c1ccc2nc(COc3ccccc3F)cn2c1
InChIInChI=1S/C16H13FN2O3/c1-21-16(20)11-6-7-15-18-12(9-19(15)8-11)10-22-14-5-3-2-4-13(14)17/h2-9H,10H2,1H3
InChIKeySWZWTYOQODAZGC-UHFFFAOYSA-N
MW300.29 g/mol
LogP2.84
Rot. Bonds4

About methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate

methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate (PubChem CID 117256129) has the molecular formula C16H13FN2O3 and a molecular weight of 300.29 g/mol. Its IUPAC name is methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate.

Molecular Properties

Compound Namemethyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate
PubChem CID117256129
Molecular FormulaC16H13FN2O3
Molecular Weight300.29 g/mol
Exact Mass300.09
IUPAC Namemethyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate
SMILESCOC(=O)c1ccc2nc(COc3ccccc3F)cn2c1
InChIInChI=1S/C16H13FN2O3/c1-21-16(20)11-6-7-15-18-12(9-19(15)8-11)10-22-14-5-3-2-4-13(14)17/h2-9H,10H2,1H3
InChIKeySWZWTYOQODAZGC-UHFFFAOYSA-N
XLogP2.84
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.29
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[(4-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate
CID 117256154
2-[(2-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylic acid
CID 117256132
methyl 2-(methylsulfanylmethyl)imidazo[1,2-a]pyridine-6-carboxylate
CID 117256159
methyl 3-fluoro-4-[(2-fluorophenoxy)methyl]benzoate
CID 71089392
2-[(2-fluorophenyl)methyl]imidazo[1,2-a]pyridine-6-carboxylic acid
CID 117130528
methyl 3-fluoro-4-(pyridin-2-ylmethoxy)benzoate
CID 69001811
6-methoxycarbonylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 83837508
methyl 2-heptan-4-ylimidazo[1,2-a]pyridine-6-carboxylate
CID 175739428
(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl 2-fluorobenzoate
CID 24686105
imidazo[1,2-a]pyridin-2-ylmethyl 3-fluoro-4-methoxybenzoate
CID 7523277
N-(3-hydroxypropyl)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 78876020
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 112830411

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate?
The IUPAC name of methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate (CID 117256129) is methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate.
What is the SMILES notation for methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate?
The canonical SMILES for methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate is COC(=O)c1ccc2nc(COc3ccccc3F)cn2c1.
What is the InChIKey of methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate?
The InChIKey is SWZWTYOQODAZGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O3/c1-21-16(20)11-6-7-15-18-12(9-19(15)8-11)10-22-14-5-3-2-4-13(14)17/h2-9H,10H2,1H3.
What are the key properties of methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate?
methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate has a molecular weight of 300.29 g/mol, XLogP of 2.84, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate is sourced from PubChem (CID 117256129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).