methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate

C15H12N2O3 — CID 117133044

IUPACmethyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate
SMILESCOC(=O)c1cccc2nc(-c3cccc(O)c3)cn12
InChIInChI=1S/C15H12N2O3/c1-20-15(19)13-6-3-7-14-16-12(9-17(13)14)10-4-2-5-11(18)8-10/h2-9,18H,1H3
InChIKeyNSPFOQDLDANNIA-UHFFFAOYSA-N
MW268.27 g/mol
LogP2.49
Rot. Bonds2

About methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate

methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate (PubChem CID 117133044) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate.

Molecular Properties

Compound Namemethyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate
PubChem CID117133044
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC Namemethyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate
SMILESCOC(=O)c1cccc2nc(-c3cccc(O)c3)cn12
InChIInChI=1S/C15H12N2O3/c1-20-15(19)13-6-3-7-14-16-12(9-17(13)14)10-4-2-5-11(18)8-10/h2-9,18H,1H3
InChIKeyNSPFOQDLDANNIA-UHFFFAOYSA-N
XLogP2.49
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-phenylimidazo[1,2-a]pyridine-5-carboxylate
CID 117133039
methyl 2-(4-fluorophenyl)imidazo[1,2-a]pyridine-5-carboxylate
CID 117133201
methyl 7-methoxy-2-phenylimidazo[1,2-a]pyridine-5-carboxylate
CID 42609556
methyl 4-(3-hydroxyphenyl)-1-methylpyrrole-2-carboxylate
CID 56712674
methyl 2-[(4-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 117255839
methyl 2-[(3-chlorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 117255825
methyl 2-[(2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 117255815
methyl 2-[(4-thiophen-3-yltriazol-1-yl)methyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 167913159
methyl 3-amino-5-(3-hydroxyphenyl)benzoate
CID 164888360
methyl 2-[(1,1-dioxothiolan-3-yl)methyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 117131444
methyl 2-[2-(phenylmethoxycarbonylamino)ethyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 67449555
2-methyl-N-[3-(5-methylimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide
CID 3499762

Frequently Asked Questions

What is the IUPAC name of methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate?
The IUPAC name of methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate (CID 117133044) is methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate.
What is the SMILES notation for methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate?
The canonical SMILES for methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate is COC(=O)c1cccc2nc(-c3cccc(O)c3)cn12.
What is the InChIKey of methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate?
The InChIKey is NSPFOQDLDANNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c1-20-15(19)13-6-3-7-14-16-12(9-17(13)14)10-4-2-5-11(18)8-10/h2-9,18H,1H3.
What are the key properties of methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate?
methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate has a molecular weight of 268.27 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(3-hydroxyphenyl)imidazo[1,2-a]pyridine-5-carboxylate is sourced from PubChem (CID 117133044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).