2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid

C18H18N2O3 — CID 150512858

IUPAC2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid
SMILESCCC(C(=O)O)c1c(-c2ccccc2)nc2cc(OC)ccn12
InChIInChI=1S/C18H18N2O3/c1-3-14(18(21)22)17-16(12-7-5-4-6-8-12)19-15-11-13(23-2)9-10-20(15)17/h4-11,14H,3H2,1-2H3,(H,21,22)
InChIKeyIAFKYBPBVYOEKY-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.59
Rot. Bonds5

About 2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid

2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid (PubChem CID 150512858) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid.

Molecular Properties

Compound Name2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid
PubChem CID150512858
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid
SMILESCCC(C(=O)O)c1c(-c2ccccc2)nc2cc(OC)ccn12
InChIInChI=1S/C18H18N2O3/c1-3-14(18(21)22)17-16(12-7-5-4-6-8-12)19-15-11-13(23-2)9-10-20(15)17/h4-11,14H,3H2,1-2H3,(H,21,22)
InChIKeyIAFKYBPBVYOEKY-UHFFFAOYSA-N
XLogP3.59
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Miroprofen
CID 68752
3-(8-Methyl-2-imidazo[1,2-a]pyridinyl)-1-benzopyran-2-one
CID 767302
3-(7-Methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one
CID 830970
2-(8-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide
CID 10546805
2-(6-Methoxy-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-acetamide
CID 10690208
3-(imidazo[1,2-a]pyridin-2-yl)-2H-chromen-2-one
CID 397075
2-[1-[(4-Methoxyphenyl)methyl]-2-methylpyrrolo[2,3-b]pyridin-3-yl]acetic acid
CID 11709353
2-[5-(4-Methoxyphenyl)-1-methylimidazol-4-yl]pyridine-4-carboxylic acid
CID 90407809
2-[6-(3-Phenylmethoxyphenyl)imidazo[1,2-b]pyridazin-2-yl]acetic acid
CID 154659094
2-[6-(3-Methoxyphenyl)imidazo[1,2-b]pyridazin-2-yl]acetic acid
CID 154659101
2-[6-(4-Methoxyphenyl)imidazo[1,2-b]pyridazin-2-yl]acetic acid
CID 155019861
GPR40 agonist 5
CID 156013404

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid?
The IUPAC name of 2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid (CID 150512858) is 2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid.
What is the SMILES notation for 2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid?
The canonical SMILES for 2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid is CCC(C(=O)O)c1c(-c2ccccc2)nc2cc(OC)ccn12.
What is the InChIKey of 2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid?
The InChIKey is IAFKYBPBVYOEKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-3-14(18(21)22)17-16(12-7-5-4-6-8-12)19-15-11-13(23-2)9-10-20(15)17/h4-11,14H,3H2,1-2H3,(H,21,22).
What are the key properties of 2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid?
2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid has a molecular weight of 310.35 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)butanoic acid is sourced from PubChem (CID 150512858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).