5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid

C14H19N3O3 — CID 63157572

IUPAC5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid
SMILESCCC1CCCCN1C(=O)Nc1cncc(C(=O)O)c1
InChIInChI=1S/C14H19N3O3/c1-2-12-5-3-4-6-17(12)14(20)16-11-7-10(13(18)19)8-15-9-11/h7-9,12H,2-6H2,1H3,(H,16,20)(H,18,19)
InChIKeyCYCATGCSQKGUNG-UHFFFAOYSA-N
MW277.32 g/mol
LogP2.58
Rot. Bonds3

About 5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid

5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid (PubChem CID 63157572) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid
PubChem CID63157572
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid
SMILESCCC1CCCCN1C(=O)Nc1cncc(C(=O)O)c1
InChIInChI=1S/C14H19N3O3/c1-2-12-5-3-4-6-17(12)14(20)16-11-7-10(13(18)19)8-15-9-11/h7-9,12H,2-6H2,1H3,(H,16,20)(H,18,19)
InChIKeyCYCATGCSQKGUNG-UHFFFAOYSA-N
XLogP2.58
TPSA82.53 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[[2-(hydroxymethyl)piperidine-1-carbonyl]amino]pyridine-3-carboxylic acid
CID 63157945
5-[(2-carbamoylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid
CID 63157950
(2R)-2-ethyl-N-phenylpiperidine-1-carboxamide
CID 728630
(2R)-2-ethyl-N-[3-[[(2R)-2-ethylpiperidine-1-carbonyl]amino]phenyl]piperidine-1-carboxamide
CID 7190614
5-(2-ethylpyrrolidine-1-carbonyl)pyridine-3-carboxylic acid
CID 21062091
5-[(2S)-2-ethylpyrrolidine-1-carbonyl]pyridine-3-carboxylic acid
CID 58714763
[5-(cyclohexylamino)-3-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 109226885
(2S)-2-ethyl-N-(2-phenylpyrimidin-5-yl)piperidine-1-carboxamide
CID 97201683
5-[(3-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid
CID 63157800
[5-(butan-2-ylamino)-3-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 109225384
3-[1-[(5-methyl-3-pyridinyl)carbamoyl]piperidin-2-yl]propanoic acid
CID 107585962
5-[(2-ethylazepane-1-carbonyl)amino]pyridine-2-carboxylic acid
CID 104690906

Frequently Asked Questions

What is the IUPAC name of 5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid?
The IUPAC name of 5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid (CID 63157572) is 5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid.
What is the SMILES notation for 5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid?
The canonical SMILES for 5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid is CCC1CCCCN1C(=O)Nc1cncc(C(=O)O)c1.
What is the InChIKey of 5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid?
The InChIKey is CYCATGCSQKGUNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-2-12-5-3-4-6-17(12)14(20)16-11-7-10(13(18)19)8-15-9-11/h7-9,12H,2-6H2,1H3,(H,16,20)(H,18,19).
What are the key properties of 5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid?
5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid has a molecular weight of 277.32 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-ethylpiperidine-1-carbonyl)amino]pyridine-3-carboxylic acid is sourced from PubChem (CID 63157572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).