2-(6-amino-3-pyridinyl)acetic acid

C7H8N2O2 — CID 12562075

IUPAC2-(6-amino-3-pyridinyl)acetic acid
SMILESNc1ccc(CC(=O)O)cn1
InChIInChI=1S/C7H8N2O2/c8-6-2-1-5(4-9-6)3-7(10)11/h1-2,4H,3H2,(H2,8,9)(H,10,11)
InChIKeyCKUZZJJDLFBRDE-UHFFFAOYSA-N
MW152.15 g/mol
LogP0.29
Rot. Bonds2

About 2-(6-amino-3-pyridinyl)acetic acid

2-(6-amino-3-pyridinyl)acetic acid (PubChem CID 12562075) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 2-(6-amino-3-pyridinyl)acetic acid.

Molecular Properties

Compound Name2-(6-amino-3-pyridinyl)acetic acid
PubChem CID12562075
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name2-(6-amino-3-pyridinyl)acetic acid
SMILESNc1ccc(CC(=O)O)cn1
InChIInChI=1S/C7H8N2O2/c8-6-2-1-5(4-9-6)3-7(10)11/h1-2,4H,3H2,(H2,8,9)(H,10,11)
InChIKeyCKUZZJJDLFBRDE-UHFFFAOYSA-N
XLogP0.29
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-Pyridineacetic acid
CID 108
Azd-9684
CID 87609775
3-(Pyridin-4-yl)propanoic acid
CID 233243
2-Aminopyridine-4-carboxylic acid
CID 278396
Methyl pyridine-3-acetate
CID 96475
AD-1491
CID 3059294
2-(Methylamino)pyridine-4-carboxylic acid
CID 6484235
2-(2-Aminopyridin-4-yl)acetic acid
CID 29921676
3-Pyridineacetic acid, hydrochloride (1:1)
CID 2723724
6-[(Pyridin-4-ylmethyl)amino]hexanoic acid
CID 3240263
7-Pyridin-3-yl-hept-6-enoic acid
CID 44330921
alpha-Methyl-3-pyridineacetic acid
CID 10511017

Frequently Asked Questions

What is the IUPAC name of 2-(6-amino-3-pyridinyl)acetic acid?
The IUPAC name of 2-(6-amino-3-pyridinyl)acetic acid (CID 12562075) is 2-(6-amino-3-pyridinyl)acetic acid.
What is the SMILES notation for 2-(6-amino-3-pyridinyl)acetic acid?
The canonical SMILES for 2-(6-amino-3-pyridinyl)acetic acid is Nc1ccc(CC(=O)O)cn1.
What is the InChIKey of 2-(6-amino-3-pyridinyl)acetic acid?
The InChIKey is CKUZZJJDLFBRDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c8-6-2-1-5(4-9-6)3-7(10)11/h1-2,4H,3H2,(H2,8,9)(H,10,11).
What are the key properties of 2-(6-amino-3-pyridinyl)acetic acid?
2-(6-amino-3-pyridinyl)acetic acid has a molecular weight of 152.15 g/mol, XLogP of 0.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-amino-3-pyridinyl)acetic acid is sourced from PubChem (CID 12562075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).