1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid

C15H18N4O2 — CID 90488114

IUPAC1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid
SMILESCc1nc2cc(N3CCCC(C(=O)O)C3)cnc2nc1C
InChIInChI=1S/C15H18N4O2/c1-9-10(2)18-14-13(17-9)6-12(7-16-14)19-5-3-4-11(8-19)15(20)21/h6-7,11H,3-5,8H2,1-2H3,(H,20,21)
InChIKeyONKBMLXPNZWDRP-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.94
Rot. Bonds2

About 1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid

1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid (PubChem CID 90488114) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid.

Molecular Properties

Compound Name1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid
PubChem CID90488114
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid
SMILESCc1nc2cc(N3CCCC(C(=O)O)C3)cnc2nc1C
InChIInChI=1S/C15H18N4O2/c1-9-10(2)18-14-13(17-9)6-12(7-16-14)19-5-3-4-11(8-19)15(20)21/h6-7,11H,3-5,8H2,1-2H3,(H,20,21)
InChIKeyONKBMLXPNZWDRP-UHFFFAOYSA-N
XLogP1.94
TPSA79.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid?
The IUPAC name of 1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid (CID 90488114) is 1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid.
What is the SMILES notation for 1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid?
The canonical SMILES for 1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid is Cc1nc2cc(N3CCCC(C(=O)O)C3)cnc2nc1C.
What is the InChIKey of 1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid?
The InChIKey is ONKBMLXPNZWDRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-9-10(2)18-14-13(17-9)6-12(7-16-14)19-5-3-4-11(8-19)15(20)21/h6-7,11H,3-5,8H2,1-2H3,(H,20,21).
What are the key properties of 1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid?
1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid has a molecular weight of 286.34 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylpyrido[2,3-b]pyrazin-7-yl)piperidine-3-carboxylic acid is sourced from PubChem (CID 90488114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).