6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid

C14H22N2O3 — CID 55053038

IUPAC6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid
SMILESCCC(CC)N(CCOC)c1cccc(C(=O)O)n1
InChIInChI=1S/C14H22N2O3/c1-4-11(5-2)16(9-10-19-3)13-8-6-7-12(15-13)14(17)18/h6-8,11H,4-5,9-10H2,1-3H3,(H,17,18)
InChIKeyGSVHSJVLKDBNPR-UHFFFAOYSA-N
MW266.34 g/mol
LogP2.42
Rot. Bonds8

About 6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid

6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid (PubChem CID 55053038) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid
PubChem CID55053038
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid
SMILESCCC(CC)N(CCOC)c1cccc(C(=O)O)n1
InChIInChI=1S/C14H22N2O3/c1-4-11(5-2)16(9-10-19-3)13-8-6-7-12(15-13)14(17)18/h6-8,11H,4-5,9-10H2,1-3H3,(H,17,18)
InChIKeyGSVHSJVLKDBNPR-UHFFFAOYSA-N
XLogP2.42
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-fluoro-N-(2-methoxyethyl)-N-pentan-3-ylpyridin-2-amine
CID 55002889
[6-[2-methoxyethyl(pentan-3-yl)amino]-2-pyridinyl]methanol
CID 62255181
6-(chloromethyl)-N-(2-methoxyethyl)-N-pentan-3-ylpyridin-2-amine
CID 55052887
6-[3-methoxypropyl(methyl)amino]pyridine-2-carboxylic acid
CID 63009746
6-[2-methoxyethyl(propan-2-yl)carbamoyl]pyridine-2-carboxylic acid
CID 82960080
6-(dimethylamino)pyridine-2-carboxylic acid
CID 53408411
6-[2-methoxyethyl(propan-2-yl)amino]pyrazine-2-carboxylic acid
CID 82950912
6-[methyl(2-propan-2-yloxyethyl)amino]pyridine-2-carboxylic acid
CID 81055123
3-[2-methoxyethyl(pentan-3-yl)amino]pyrazine-2-carboxylic acid
CID 62702545
6-[3-methoxypropyl(methyl)carbamoyl]pyridine-2-carboxylic acid
CID 55140872
5-chloro-6-(chloromethyl)-N-(2-methoxyethyl)-N-pentan-3-ylpyridin-2-amine
CID 55003117
[6-[2-methoxyethyl(pentan-3-yl)amino]pyrazin-2-yl]methanol
CID 66466606

Frequently Asked Questions

What is the IUPAC name of 6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid?
The IUPAC name of 6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid (CID 55053038) is 6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid?
The canonical SMILES for 6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid is CCC(CC)N(CCOC)c1cccc(C(=O)O)n1.
What is the InChIKey of 6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid?
The InChIKey is GSVHSJVLKDBNPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-4-11(5-2)16(9-10-19-3)13-8-6-7-12(15-13)14(17)18/h6-8,11H,4-5,9-10H2,1-3H3,(H,17,18).
What are the key properties of 6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid?
6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid has a molecular weight of 266.34 g/mol, XLogP of 2.42, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-methoxyethyl(pentan-3-yl)amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 55053038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).