2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid

C10H14N2O2 — CID 60678572

IUPAC2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid
SMILESCc1cc(C)c(C(=O)O)c(N(C)C)n1
InChIInChI=1S/C10H14N2O2/c1-6-5-7(2)11-9(12(3)4)8(6)10(13)14/h5H,1-4H3,(H,13,14)
InChIKeyCMGJKDFRAMBXAH-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.46
Rot. Bonds2

About 2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid

2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid (PubChem CID 60678572) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid
PubChem CID60678572
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid
SMILESCc1cc(C)c(C(=O)O)c(N(C)C)n1
InChIInChI=1S/C10H14N2O2/c1-6-5-7(2)11-9(12(3)4)8(6)10(13)14/h5H,1-4H3,(H,13,14)
InChIKeyCMGJKDFRAMBXAH-UHFFFAOYSA-N
XLogP1.46
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid?
The IUPAC name of 2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid (CID 60678572) is 2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid.
What is the SMILES notation for 2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid?
The canonical SMILES for 2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid is Cc1cc(C)c(C(=O)O)c(N(C)C)n1.
What is the InChIKey of 2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid?
The InChIKey is CMGJKDFRAMBXAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-6-5-7(2)11-9(12(3)4)8(6)10(13)14/h5H,1-4H3,(H,13,14).
What are the key properties of 2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid?
2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid has a molecular weight of 194.23 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-4,6-dimethylpyridine-3-carboxylic acid is sourced from PubChem (CID 60678572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).