2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid

C10H9N3O2 — CID 121213660

IUPAC2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid
SMILESO=C(O)Cc1cn[nH]c1-c1ccccn1
InChIInChI=1S/C10H9N3O2/c14-9(15)5-7-6-12-13-10(7)8-3-1-2-4-11-8/h1-4,6H,5H2,(H,12,13)(H,14,15)
InChIKeyWEAWWVWAVIBFSU-UHFFFAOYSA-N
MW203.20 g/mol
LogP1.10
Rot. Bonds3

About 2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid

2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid (PubChem CID 121213660) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is 2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid.

Molecular Properties

Compound Name2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid
PubChem CID121213660
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid
SMILESO=C(O)Cc1cn[nH]c1-c1ccccn1
InChIInChI=1S/C10H9N3O2/c14-9(15)5-7-6-12-13-10(7)8-3-1-2-4-11-8/h1-4,6H,5H2,(H,12,13)(H,14,15)
InChIKeyWEAWWVWAVIBFSU-UHFFFAOYSA-N
XLogP1.10
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid?
The IUPAC name of 2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid (CID 121213660) is 2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid.
What is the SMILES notation for 2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid?
The canonical SMILES for 2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid is O=C(O)Cc1cn[nH]c1-c1ccccn1.
What is the InChIKey of 2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid?
The InChIKey is WEAWWVWAVIBFSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c14-9(15)5-7-6-12-13-10(7)8-3-1-2-4-11-8/h1-4,6H,5H2,(H,12,13)(H,14,15).
What are the key properties of 2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid?
2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid has a molecular weight of 203.20 g/mol, XLogP of 1.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid is sourced from PubChem (CID 121213660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).