methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate

C16H14N2O3 — CID 155234885

IUPACmethyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate
SMILESCOC(=O)c1ccn2c(-c3ccccc3OC)cnc2c1
InChIInChI=1S/C16H14N2O3/c1-20-14-6-4-3-5-12(14)13-10-17-15-9-11(16(19)21-2)7-8-18(13)15/h3-10H,1-2H3
InChIKeyGJUOTTVQINLZFF-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.80
Rot. Bonds3

About methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate

methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate (PubChem CID 155234885) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate.

Molecular Properties

Compound Namemethyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate
PubChem CID155234885
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC Namemethyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate
SMILESCOC(=O)c1ccn2c(-c3ccccc3OC)cnc2c1
InChIInChI=1S/C16H14N2O3/c1-20-14-6-4-3-5-12(14)13-10-17-15-9-11(16(19)21-2)7-8-18(13)15/h3-10H,1-2H3
InChIKeyGJUOTTVQINLZFF-UHFFFAOYSA-N
XLogP2.80
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate?
The IUPAC name of methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate (CID 155234885) is methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate.
What is the SMILES notation for methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate?
The canonical SMILES for methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate is COC(=O)c1ccn2c(-c3ccccc3OC)cnc2c1.
What is the InChIKey of methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate?
The InChIKey is GJUOTTVQINLZFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-20-14-6-4-3-5-12(14)13-10-17-15-9-11(16(19)21-2)7-8-18(13)15/h3-10H,1-2H3.
What are the key properties of methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate?
methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate has a molecular weight of 282.30 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate is sourced from PubChem (CID 155234885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).