4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid

C15H13NO3 — CID 43326034

IUPAC4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid
SMILESO=C(O)c1cc(Oc2ccc3c(c2)CCC3)ccn1
InChIInChI=1S/C15H13NO3/c17-15(18)14-9-13(6-7-16-14)19-12-5-4-10-2-1-3-11(10)8-12/h4-9H,1-3H2,(H,17,18)
InChIKeyVWUQFCUZWVMNMF-UHFFFAOYSA-N
MW255.27 g/mol
LogP3.06
Rot. Bonds3

About 4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid

4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid (PubChem CID 43326034) has the molecular formula C15H13NO3 and a molecular weight of 255.27 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid
PubChem CID43326034
Molecular FormulaC15H13NO3
Molecular Weight255.27 g/mol
Exact Mass255.09
IUPAC Name4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid
SMILESO=C(O)c1cc(Oc2ccc3c(c2)CCC3)ccn1
InChIInChI=1S/C15H13NO3/c17-15(18)14-9-13(6-7-16-14)19-12-5-4-10-2-1-3-11(10)8-12/h4-9H,1-3H2,(H,17,18)
InChIKeyVWUQFCUZWVMNMF-UHFFFAOYSA-N
XLogP3.06
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid
CID 69017649
4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid
CID 43325986
6-(2,3-dihydro-1H-inden-5-yloxy)pyridazine-3-carboxylic acid
CID 60791786
4-(2,3-dihydro-1H-inden-5-yloxy)pyridine
CID 57051000
4-(2,3-dihydro-1H-inden-5-yloxy)-N-methylpyridin-2-amine
CID 113368109
4-(4-cyanophenoxy)pyridine-2-carboxylic acid
CID 43142929
4-[4-fluoro-3-(trifluoromethyl)phenoxy]pyridine-2-carboxylic acid
CID 102747015
5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]pyridine-2-carboxylic acid
CID 10246518
4-[[2-(cyclopentylamino)-1,3-benzoxazol-6-yl]oxy]pyridine-2-carboxylic acid
CID 142780749
4-cyclohexyloxypyridine-2-carboxylic acid
CID 43142909
4-(3-chloro-4-nitrophenoxy)pyridine-2-carboxylic acid
CID 62111596
4-(4-imidazol-1-ylphenoxy)pyridine-2-carboxylic acid
CID 67405266

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid?
The IUPAC name of 4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid (CID 43326034) is 4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid.
What is the SMILES notation for 4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid?
The canonical SMILES for 4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid is O=C(O)c1cc(Oc2ccc3c(c2)CCC3)ccn1.
What is the InChIKey of 4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid?
The InChIKey is VWUQFCUZWVMNMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3/c17-15(18)14-9-13(6-7-16-14)19-12-5-4-10-2-1-3-11(10)8-12/h4-9H,1-3H2,(H,17,18).
What are the key properties of 4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid?
4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid has a molecular weight of 255.27 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid is sourced from PubChem (CID 43326034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).