3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid

C18H18N2O2 — CID 42879887

IUPAC3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid
SMILESCc1cccc(C(CC(=O)O)c2cnc3cc(C)ccn23)c1
InChIInChI=1S/C18H18N2O2/c1-12-4-3-5-14(8-12)15(10-18(21)22)16-11-19-17-9-13(2)6-7-20(16)17/h3-9,11,15H,10H2,1-2H3,(H,21,22)
InChIKeyWDZDFNBYCYMUPV-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.56
Rot. Bonds4

About 3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid

3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid (PubChem CID 42879887) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid.

Molecular Properties

Compound Name3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid
PubChem CID42879887
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid
SMILESCc1cccc(C(CC(=O)O)c2cnc3cc(C)ccn23)c1
InChIInChI=1S/C18H18N2O2/c1-12-4-3-5-14(8-12)15(10-18(21)22)16-11-19-17-9-13(2)6-7-20(16)17/h3-9,11,15H,10H2,1-2H3,(H,21,22)
InChIKeyWDZDFNBYCYMUPV-UHFFFAOYSA-N
XLogP3.56
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-phenyl-N-(1-phenylethyl)propanamide
CID 4684372
3-(5-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid
CID 42879881
(3S)-3-(3-methoxyphenyl)-3-(7-methylimidazo[1,2-a]pyridin-3-yl)-N-propan-2-ylpropanamide
CID 7332110
3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-phenyl-N,N-dipropylpropanamide
CID 42784088
3-(3-methoxyphenyl)-3-(7-methylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylpropanamide
CID 3460698
3-(7-methylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-3-[3-(trifluoromethyl)phenyl]propanamide
CID 3341343
3-(3-fluorophenyl)-N-(2-methoxyethyl)-3-(7-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 42784164
3-(3-methoxyphenyl)-3-(7-methylimidazo[1,2-a]pyridin-3-yl)-1-(4-methylpiperidin-1-yl)propan-1-one
CID 3311606
3-(7-methylimidazo[1,2-a]pyridin-3-yl)-1-(4-methylpiperidin-1-yl)-3-[3-(trifluoromethyl)phenyl]propan-1-one
CID 4206782
(3R)-3-hydroxy-3-(3-methylphenyl)propanoic acid
CID 11708164
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-phenylpropanamide
CID 4119452
N-[2-(2,4-dichlorophenyl)ethyl]-3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide
CID 4160925

Frequently Asked Questions

What is the IUPAC name of 3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid?
The IUPAC name of 3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid (CID 42879887) is 3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid.
What is the SMILES notation for 3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid?
The canonical SMILES for 3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid is Cc1cccc(C(CC(=O)O)c2cnc3cc(C)ccn23)c1.
What is the InChIKey of 3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid?
The InChIKey is WDZDFNBYCYMUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-12-4-3-5-14(8-12)15(10-18(21)22)16-11-19-17-9-13(2)6-7-20(16)17/h3-9,11,15H,10H2,1-2H3,(H,21,22).
What are the key properties of 3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid?
3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid has a molecular weight of 294.35 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid is sourced from PubChem (CID 42879887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).