6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid

C17H13N3O2 — CID 91163878

IUPAC6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid
SMILESCc1cccc(-c2cccc(-c3cccc(C(=O)O)n3)n2)n1
InChIInChI=1S/C17H13N3O2/c1-11-5-2-6-12(18-11)13-7-3-8-14(19-13)15-9-4-10-16(20-15)17(21)22/h2-10H,1H3,(H,21,22)
InChIKeyWVUUNEQAXXQNDY-UHFFFAOYSA-N
MW291.31 g/mol
LogP3.21
Rot. Bonds3

About 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid

6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid (PubChem CID 91163878) has the molecular formula C17H13N3O2 and a molecular weight of 291.31 g/mol. Its IUPAC name is 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid
PubChem CID91163878
Molecular FormulaC17H13N3O2
Molecular Weight291.31 g/mol
Exact Mass291.10
IUPAC Name6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid
SMILESCc1cccc(-c2cccc(-c3cccc(C(=O)O)n3)n2)n1
InChIInChI=1S/C17H13N3O2/c1-11-5-2-6-12(18-11)13-7-3-8-14(19-13)15-9-4-10-16(20-15)17(21)22/h2-10H,1H3,(H,21,22)
InChIKeyWVUUNEQAXXQNDY-UHFFFAOYSA-N
XLogP3.21
TPSA75.97 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.31
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,6-Pyridinedicarboxylic acid
CID 10367
Chromium(III) picolinate
CID 151932
6-Methylpyridine-2-carboxylic acid
CID 70282
6-(Methoxycarbonyl)pyridine-2-carboxylic acid
CID 4019172
Chromium picolinate monohydrate
CID 22833491
Hydroxy(6-methyl-2-pyridyl)methyl 6-methyl-2-pyridyl ketone
CID 97927
6-(6-(7-Phenylheptanoyl)-pyridazin-3-yl)-picolinic Acid
CID 24948911
6-[[2-[(6-Carboxy-2-pyridinyl)methylamino]ethylamino]methyl]pyridine-2-carboxylic acid
CID 58567052
6-(Methylcarbamoyl)pyridine-2-carboxylic acid
CID 43558273
6-Phenylpyridine-2-carboxylic Acid
CID 2762884
2,2'-Bipyridine-6,6'-dicarboxylic Acid
CID 9959961
6-(Hydroxymethyl)picolinic acid
CID 11789404

Frequently Asked Questions

What is the IUPAC name of 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid?
The IUPAC name of 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid (CID 91163878) is 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid?
The canonical SMILES for 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid is Cc1cccc(-c2cccc(-c3cccc(C(=O)O)n3)n2)n1.
What is the InChIKey of 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid?
The InChIKey is WVUUNEQAXXQNDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O2/c1-11-5-2-6-12(18-11)13-7-3-8-14(19-13)15-9-4-10-16(20-15)17(21)22/h2-10H,1H3,(H,21,22).
What are the key properties of 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid?
6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid has a molecular weight of 291.31 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 91163878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).