3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid

C11H11NO3 — CID 84778212

IUPAC3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid
SMILESCC(Cc1coc2cnccc12)C(=O)O
InChIInChI=1S/C11H11NO3/c1-7(11(13)14)4-8-6-15-10-5-12-3-2-9(8)10/h2-3,5-7H,4H2,1H3,(H,13,14)
InChIKeyRLVJOUFWOPPPEL-UHFFFAOYSA-N
MW205.21 g/mol
LogP2.09
Rot. Bonds3

About 3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid

3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid (PubChem CID 84778212) has the molecular formula C11H11NO3 and a molecular weight of 205.21 g/mol. Its IUPAC name is 3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid.

Molecular Properties

Compound Name3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid
PubChem CID84778212
Molecular FormulaC11H11NO3
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid
SMILESCC(Cc1coc2cnccc12)C(=O)O
InChIInChI=1S/C11H11NO3/c1-7(11(13)14)4-8-6-15-10-5-12-3-2-9(8)10/h2-3,5-7H,4H2,1H3,(H,13,14)
InChIKeyRLVJOUFWOPPPEL-UHFFFAOYSA-N
XLogP2.09
TPSA63.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-(3-methyl-4-pyridinyl)propanoic acid
CID 115008773
3-(4-fluoro-1-benzofuran-3-yl)-2-methylpropanoic acid
CID 117119182
(2S)-3-(1-benzofuran-3-yl)-2-(methylamino)propanoic acid
CID 172529455
4-(1-benzofuran-3-yl)-3-methylbutanoic acid
CID 116926807
ethane;3-methylfuro[2,3-c]pyridine
CID 156844588
4-(1-benzofuran-3-ylmethylamino)-2-methyl-4-oxobutanoic acid
CID 115165103
2-([1,2]oxazolo[5,4-c]pyridin-3-yl)acetic acid
CID 84656296
3-(2-chloro-3-pyridinyl)-2-methylpropanoic acid
CID 139894647
2-methyl-3-[(3-methyl-4-pyridinyl)methylamino]propanoic acid
CID 114699734
3-furo[2,3-c]pyridin-5-yl-2-methylpropanoic acid
CID 84778209
3-[1-benzofuran-3-ylmethylcarbamoyl(methyl)amino]-2-methylpropanoic acid
CID 122002286
1-(1-benzofuran-3-yl)-3-methylbutan-2-one
CID 164836556

Frequently Asked Questions

What is the IUPAC name of 3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid?
The IUPAC name of 3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid (CID 84778212) is 3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid.
What is the SMILES notation for 3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid?
The canonical SMILES for 3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid is CC(Cc1coc2cnccc12)C(=O)O.
What is the InChIKey of 3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid?
The InChIKey is RLVJOUFWOPPPEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c1-7(11(13)14)4-8-6-15-10-5-12-3-2-9(8)10/h2-3,5-7H,4H2,1H3,(H,13,14).
What are the key properties of 3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid?
3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid has a molecular weight of 205.21 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-furo[2,3-c]pyridin-3-yl-2-methylpropanoic acid is sourced from PubChem (CID 84778212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).