2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid

C15H16N2O2 — CID 82120489

IUPAC2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid
SMILESCc1cc(C(=O)O)c(N(C)C)nc1-c1ccccc1
InChIInChI=1S/C15H16N2O2/c1-10-9-12(15(18)19)14(17(2)3)16-13(10)11-7-5-4-6-8-11/h4-9H,1-3H3,(H,18,19)
InChIKeyZIPSRIACVVPKBJ-UHFFFAOYSA-N
MW256.30 g/mol
LogP2.82
Rot. Bonds3

About 2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid

2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid (PubChem CID 82120489) has the molecular formula C15H16N2O2 and a molecular weight of 256.30 g/mol. Its IUPAC name is 2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid
PubChem CID82120489
Molecular FormulaC15H16N2O2
Molecular Weight256.30 g/mol
Exact Mass256.12
IUPAC Name2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid
SMILESCc1cc(C(=O)O)c(N(C)C)nc1-c1ccccc1
InChIInChI=1S/C15H16N2O2/c1-10-9-12(15(18)19)14(17(2)3)16-13(10)11-7-5-4-6-8-11/h4-9H,1-3H3,(H,18,19)
InChIKeyZIPSRIACVVPKBJ-UHFFFAOYSA-N
XLogP2.82
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-5-methyl-6-(4-methylphenyl)pyridine-3-carboxylic acid
CID 82121831
6-(4-bromophenyl)-2,5-dimethylpyridine-3-carboxylic acid
CID 112562057
ethyl 5-cyano-6-(dimethylamino)-2-phenylpyridine-3-carboxylate
CID 1489423
ethyl 5-methyl-6-phenyl-2-propan-2-ylpyridine-3-carboxylate
CID 116533372
2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid
CID 82123788
6-(4-chlorophenyl)-5-methyl-2-(methylamino)pyridine-3-carboxylic acid
CID 94285501
N,N-dimethyl-6-(4-methylphenyl)-3-phenyl-1,2,4-triazin-5-amine
CID 6403262
2-[3-(dimethylamino)phenyl]benzoic acid
CID 39226074
6-(3-fluorophenyl)-5-methyl-2-propylpyridine-3-carboxylic acid
CID 114872887
6-(3-chlorophenyl)-5-methyl-2-propylpyridine-3-carboxylic acid
CID 116533201
3-methyl-2-phenylpyridine-4-carboxylic acid
CID 83916989
2-(3,5-dimethyl-6-phenyl-2-pyridinyl)phenol
CID 140883622

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid?
The IUPAC name of 2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid (CID 82120489) is 2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid.
What is the SMILES notation for 2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid?
The canonical SMILES for 2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid is Cc1cc(C(=O)O)c(N(C)C)nc1-c1ccccc1.
What is the InChIKey of 2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid?
The InChIKey is ZIPSRIACVVPKBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-9-12(15(18)19)14(17(2)3)16-13(10)11-7-5-4-6-8-11/h4-9H,1-3H3,(H,18,19).
What are the key properties of 2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid?
2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid has a molecular weight of 256.30 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid is sourced from PubChem (CID 82120489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).