5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid

C14H15N3O3 — CID 114406275

IUPAC5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid
SMILESCOc1ccc(N(C)c2nc(C(=O)O)ccc2N)cc1
InChIInChI=1S/C14H15N3O3/c1-17(9-3-5-10(20-2)6-4-9)13-11(15)7-8-12(16-13)14(18)19/h3-8H,15H2,1-2H3,(H,18,19)
InChIKeyUITCJGTUAFCORO-UHFFFAOYSA-N
MW273.29 g/mol
LogP2.14
Rot. Bonds4

About 5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid

5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid (PubChem CID 114406275) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid
PubChem CID114406275
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid
SMILESCOc1ccc(N(C)c2nc(C(=O)O)ccc2N)cc1
InChIInChI=1S/C14H15N3O3/c1-17(9-3-5-10(20-2)6-4-9)13-11(15)7-8-12(16-13)14(18)19/h3-8H,15H2,1-2H3,(H,18,19)
InChIKeyUITCJGTUAFCORO-UHFFFAOYSA-N
XLogP2.14
TPSA88.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-2-N-(4-methoxyphenyl)-2-N-methylpyridine-2,3-diamine
CID 115320673
methyl 5-amino-6-(4-ethyl-N-methylanilino)pyridine-2-carboxylate
CID 114406277
5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide
CID 114406485
3-amino-2-(4-methoxy-N-methylanilino)benzoic acid
CID 115934754
5-amino-6-(2-chloro-5-methoxyanilino)pyridine-2-carboxylic acid
CID 114406135
5-amino-6-[1-(4-methoxyphenyl)ethylamino]pyridine-2-carboxylic acid
CID 114406914
5-amino-6-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxylic acid
CID 107203250
5-amino-6-[1-cyclopropylethyl(methyl)amino]pyridine-2-carboxylic acid
CID 114405528
(4-methoxyphenyl)-methylcarbamic acid
CID 22047987
5-amino-6-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]pyridine-2-carboxylic acid
CID 114406077
5-amino-6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxylic acid
CID 114408647
6-(N-methylanilino)-5-nitropyridine-2-carboxylic acid
CID 114403394

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid?
The IUPAC name of 5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid (CID 114406275) is 5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid.
What is the SMILES notation for 5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid?
The canonical SMILES for 5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid is COc1ccc(N(C)c2nc(C(=O)O)ccc2N)cc1.
What is the InChIKey of 5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid?
The InChIKey is UITCJGTUAFCORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-17(9-3-5-10(20-2)6-4-9)13-11(15)7-8-12(16-13)14(18)19/h3-8H,15H2,1-2H3,(H,18,19).
What are the key properties of 5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid?
5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid has a molecular weight of 273.29 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(4-methoxy-N-methylanilino)pyridine-2-carboxylic acid is sourced from PubChem (CID 114406275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).