2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride

C8H10ClNO3 — CID 86812467

IUPAC2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride
SMILESCc1cccnc1C(O)C(=O)O.Cl
InChIInChI=1S/C8H9NO3.ClH/c1-5-3-2-4-9-6(5)7(10)8(11)12;/h2-4,7,10H,1H3,(H,11,12);1H
InChIKeyYGYXANRXGHDYTA-UHFFFAOYSA-N
MW203.63 g/mol
LogP0.93
Rot. Bonds2

About 2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride

2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride (PubChem CID 86812467) has the molecular formula C8H10ClNO3 and a molecular weight of 203.63 g/mol. Its IUPAC name is 2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride.

Molecular Properties

Compound Name2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride
PubChem CID86812467
Molecular FormulaC8H10ClNO3
Molecular Weight203.63 g/mol
Exact Mass203.03
IUPAC Name2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride
SMILESCc1cccnc1C(O)C(=O)O.Cl
InChIInChI=1S/C8H9NO3.ClH/c1-5-3-2-4-9-6(5)7(10)8(11)12;/h2-4,7,10H,1H3,(H,11,12);1H
InChIKeyYGYXANRXGHDYTA-UHFFFAOYSA-N
XLogP0.93
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.63
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride?
The IUPAC name of 2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride (CID 86812467) is 2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride.
What is the SMILES notation for 2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride?
The canonical SMILES for 2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride is Cc1cccnc1C(O)C(=O)O.Cl.
What is the InChIKey of 2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride?
The InChIKey is YGYXANRXGHDYTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO3.ClH/c1-5-3-2-4-9-6(5)7(10)8(11)12;/h2-4,7,10H,1H3,(H,11,12);1H.
What are the key properties of 2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride?
2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride has a molecular weight of 203.63 g/mol, XLogP of 0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-(3-methyl-2-pyridinyl)acetic acid;hydrochloride is sourced from PubChem (CID 86812467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).