2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid

C18H14N2O2 — CID 170886833

IUPAC2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid
SMILESO=C(O)Cc1ccc(-c2ccc(-c3ccccn3)nc2)cc1
InChIInChI=1S/C18H14N2O2/c21-18(22)11-13-4-6-14(7-5-13)15-8-9-17(20-12-15)16-3-1-2-10-19-16/h1-10,12H,11H2,(H,21,22)
InChIKeyPTQVMLUALCRNAR-UHFFFAOYSA-N
MW290.32 g/mol
LogP3.44
Rot. Bonds4

About 2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid

2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid (PubChem CID 170886833) has the molecular formula C18H14N2O2 and a molecular weight of 290.32 g/mol. Its IUPAC name is 2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid.

Molecular Properties

Compound Name2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid
PubChem CID170886833
Molecular FormulaC18H14N2O2
Molecular Weight290.32 g/mol
Exact Mass290.11
IUPAC Name2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid
SMILESO=C(O)Cc1ccc(-c2ccc(-c3ccccn3)nc2)cc1
InChIInChI=1S/C18H14N2O2/c21-18(22)11-13-4-6-14(7-5-13)15-8-9-17(20-12-15)16-3-1-2-10-19-16/h1-10,12H,11H2,(H,21,22)
InChIKeyPTQVMLUALCRNAR-UHFFFAOYSA-N
XLogP3.44
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(6-pyridin-2-yl-3-pyridinyl)propanoic acid
CID 121355469
4-(6-pyridin-2-yl-3-pyridinyl)aniline
CID 129035516
3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine
CID 59724442
2-(4-pyridin-2-ylphenyl)acetamide
CID 57447645
calcium;hydride;2-(4-phenylphenyl)acetic acid
CID 174946649
bis(2-(2-pyridin-2-yl-3-pyridinyl)acetic acid);zinc
CID 166063488
2-pyridin-2-yl-5-(5-pyridin-3-yl-2-pyridinyl)pyridine
CID 100956208
2-pyridin-2-yl-5-[2-(6-pyridin-2-yl-3-pyridinyl)ethyl]pyridine
CID 102191368
2-[4-(1,8-naphthyridin-2-yl)phenyl]acetic acid
CID 139308697
4-[6-[5-(4-carboxyphenyl)-2-pyridinyl]-3-pyridinyl]benzoic acid;iridium;2-phenylpyridine
CID 170523980
2-[4-(carboxymethyl)phenyl]acetic acid;4-pyridin-4-ylpyridine
CID 139087682
2,6-dipyridin-2-yl-4-[4-[3-pyridin-2-yl-5-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]pyridine
CID 126730919

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid?
The IUPAC name of 2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid (CID 170886833) is 2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid.
What is the SMILES notation for 2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid?
The canonical SMILES for 2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid is O=C(O)Cc1ccc(-c2ccc(-c3ccccn3)nc2)cc1.
What is the InChIKey of 2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid?
The InChIKey is PTQVMLUALCRNAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2/c21-18(22)11-13-4-6-14(7-5-13)15-8-9-17(20-12-15)16-3-1-2-10-19-16/h1-10,12H,11H2,(H,21,22).
What are the key properties of 2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid?
2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid has a molecular weight of 290.32 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]acetic acid is sourced from PubChem (CID 170886833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).