5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid

C14H21N3O2 — CID 114406820

IUPAC5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid
SMILESCCC1CCC(Nc2nc(C(=O)O)ccc2N)C1C
InChIInChI=1S/C14H21N3O2/c1-3-9-4-6-11(8(9)2)16-13-10(15)5-7-12(17-13)14(18)19/h5,7-9,11H,3-4,6,15H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyHHJAXRRCVRGEFI-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.60
Rot. Bonds4

About 5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid

5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid (PubChem CID 114406820) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid
PubChem CID114406820
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid
SMILESCCC1CCC(Nc2nc(C(=O)O)ccc2N)C1C
InChIInChI=1S/C14H21N3O2/c1-3-9-4-6-11(8(9)2)16-13-10(15)5-7-12(17-13)14(18)19/h5,7-9,11H,3-4,6,15H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyHHJAXRRCVRGEFI-UHFFFAOYSA-N
XLogP2.60
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine
CID 115320867
6-[(3-ethyl-2-methylcyclopentyl)amino]pyridazine-3-carboxylic acid
CID 64923554
5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-3-carboxylic acid
CID 81439688
5-amino-6-[(1,2-dimethylpiperidin-4-yl)amino]pyridine-2-carboxylic acid
CID 114407308
2-amino-5-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-4-carboxylic acid
CID 114195184
3-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-4-carboxylic acid
CID 114288751
5-amino-6-(3-ethylpentan-3-ylamino)pyridine-2-carboxylic acid
CID 114406825
5-amino-6-(2-methylbutan-2-ylamino)pyridine-2-carboxylic acid
CID 114404928
2-N-(3-ethyl-2-methylcyclopentyl)pyridine-2,5-diamine
CID 64922502
4-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxamide
CID 64914826
5-amino-6-(cyclohexylmethylamino)pyridine-2-carboxylic acid
CID 114405447
5-amino-6-[2-[cyclopropyl(methyl)amino]propylamino]pyridine-2-carboxylic acid
CID 114133278

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid?
The IUPAC name of 5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid (CID 114406820) is 5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid?
The canonical SMILES for 5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid is CCC1CCC(Nc2nc(C(=O)O)ccc2N)C1C.
What is the InChIKey of 5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid?
The InChIKey is HHJAXRRCVRGEFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-3-9-4-6-11(8(9)2)16-13-10(15)5-7-12(17-13)14(18)19/h5,7-9,11H,3-4,6,15H2,1-2H3,(H,16,17)(H,18,19).
What are the key properties of 5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid?
5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid has a molecular weight of 263.34 g/mol, XLogP of 2.60, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-[(3-ethyl-2-methylcyclopentyl)amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 114406820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).