4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid

C14H16N4O2 — CID 114422197

IUPAC4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid
SMILESCC1CCN(c2ccc3nccnc3n2)C(C(=O)O)C1
InChIInChI=1S/C14H16N4O2/c1-9-4-7-18(11(8-9)14(19)20)12-3-2-10-13(17-12)16-6-5-15-10/h2-3,5-6,9,11H,4,7-8H2,1H3,(H,19,20)
InChIKeyICGNQRHWHUMVDF-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.71
Rot. Bonds2

About 4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid

4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid (PubChem CID 114422197) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid.

Molecular Properties

Compound Name4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid
PubChem CID114422197
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC Name4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid
SMILESCC1CCN(c2ccc3nccnc3n2)C(C(=O)O)C1
InChIInChI=1S/C14H16N4O2/c1-9-4-7-18(11(8-9)14(19)20)12-3-2-10-13(17-12)16-6-5-15-10/h2-3,5-6,9,11H,4,7-8H2,1H3,(H,19,20)
InChIKeyICGNQRHWHUMVDF-UHFFFAOYSA-N
XLogP1.71
TPSA79.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid?
The IUPAC name of 4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid (CID 114422197) is 4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid.
What is the SMILES notation for 4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid?
The canonical SMILES for 4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid is CC1CCN(c2ccc3nccnc3n2)C(C(=O)O)C1.
What is the InChIKey of 4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid?
The InChIKey is ICGNQRHWHUMVDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-9-4-7-18(11(8-9)14(19)20)12-3-2-10-13(17-12)16-6-5-15-10/h2-3,5-6,9,11H,4,7-8H2,1H3,(H,19,20).
What are the key properties of 4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid?
4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid has a molecular weight of 272.31 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid is sourced from PubChem (CID 114422197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).