methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate

C15H16N2O2 — CID 102546113

IUPACmethyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate
SMILESCOC(=O)c1ccc(N(C)c2ccccc2)nc1C
InChIInChI=1S/C15H16N2O2/c1-11-13(15(18)19-3)9-10-14(16-11)17(2)12-7-5-4-6-8-12/h4-10H,1-3H3
InChIKeyYKVCWZXVKZCEJO-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.94
Rot. Bonds3

About methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate

methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate (PubChem CID 102546113) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate
PubChem CID102546113
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Namemethyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate
SMILESCOC(=O)c1ccc(N(C)c2ccccc2)nc1C
InChIInChI=1S/C15H16N2O2/c1-11-13(15(18)19-3)9-10-14(16-11)17(2)12-7-5-4-6-8-12/h4-10H,1-3H3
InChIKeyYKVCWZXVKZCEJO-UHFFFAOYSA-N
XLogP2.94
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-methyl-6-[methyl-[1-(4-methylsulfonylphenyl)ethyl]amino]pyridine-3-carboxylate
CID 167908776
methyl 6-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]-2-methylpyridine-3-carboxylate
CID 103111674
5-(chloromethyl)-N,6-dimethyl-N-phenylpyridin-2-amine
CID 79885717
methyl 5-amino-2-(N-methylanilino)benzoate
CID 61312669
5-methoxycarbonyl-2,6-dimethylpyridine-3-carboxylic acid
CID 68669960
methyl 2-methyl-6-propan-2-ylpyridine-3-carboxylate
CID 121218957
methyl 4-[[4-(N-methylanilino)pyrimidin-2-yl]amino]benzoate
CID 112902069
methyl 6-[(4-bromo-1-methylpyrrol-2-yl)methyl-methylamino]-2-methylpyridine-3-carboxylate
CID 133419969
methyl 2-(diphenylcarbamoyl)benzoate
CID 785922
dimethyl 4,5-bis(N-phenylanilino)benzene-1,2-dicarboxylate
CID 102133313
dimethyl 2,5-bis(N-phenylanilino)benzene-1,4-dicarboxylate
CID 18332104
di(113C)methyl benzene-1,2-dicarboxylate
CID 131668060

Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate?
The IUPAC name of methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate (CID 102546113) is methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate.
What is the SMILES notation for methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate?
The canonical SMILES for methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate is COC(=O)c1ccc(N(C)c2ccccc2)nc1C.
What is the InChIKey of methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate?
The InChIKey is YKVCWZXVKZCEJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-11-13(15(18)19-3)9-10-14(16-11)17(2)12-7-5-4-6-8-12/h4-10H,1-3H3.
What are the key properties of methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate?
methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate has a molecular weight of 256.31 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-6-(N-methylanilino)pyridine-3-carboxylate is sourced from PubChem (CID 102546113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).