8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid

C13H16N4O2 — CID 166334168

IUPAC8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid
SMILESCC1CCCN(c2nccn3cc(C(=O)O)nc23)C1
InChIInChI=1S/C13H16N4O2/c1-9-3-2-5-16(7-9)11-12-15-10(13(18)19)8-17(12)6-4-14-11/h4,6,8-9H,2-3,5,7H2,1H3,(H,18,19)
InChIKeyKJJSNVIIJDLSIN-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.66
Rot. Bonds2

About 8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid

8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid (PubChem CID 166334168) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid.

Molecular Properties

Compound Name8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid
PubChem CID166334168
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid
SMILESCC1CCCN(c2nccn3cc(C(=O)O)nc23)C1
InChIInChI=1S/C13H16N4O2/c1-9-3-2-5-16(7-9)11-12-15-10(13(18)19)8-17(12)6-4-14-11/h4,6,8-9H,2-3,5,7H2,1H3,(H,18,19)
InChIKeyKJJSNVIIJDLSIN-UHFFFAOYSA-N
XLogP1.66
TPSA70.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

8-[(3R)-3-phenoxypyrrolidin-1-yl]imidazo[1,2-a]pyrazine-2-carboxylic acid
CID 166397174
8-(5-azaspiro[2.4]heptan-5-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid
CID 166378478
8-(propan-2-ylamino)imidazo[1,2-a]pyrazine-2-carboxylic acid
CID 84685605
N-cyclopropyl-2-(3-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 53015810
N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
CID 80797840
3-(3-methylpyrrolidin-1-yl)pyrazine-2-carboxylic acid
CID 62702520
6-bromo-8-piperidin-1-ylimidazo[1,2-a]pyrazine-2-carboxylic acid
CID 162374490
ethyl 8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
CID 14207617
1-(3-methylpiperidin-1-yl)isoquinoline-4-carboxylic acid
CID 106766485
2-(3-methylpiperidin-1-yl)pyridine-3-carbaldehyde
CID 102568303
tert-butyl-(1-imidazo[1,2-a]pyrazin-8-ylpyrrolidin-3-yl)carbamic acid
CID 121349537
8-piperidin-1-ylimidazo[1,2-a]pyrazine-2-carbaldehyde
CID 84693542

Frequently Asked Questions

What is the IUPAC name of 8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid?
The IUPAC name of 8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid (CID 166334168) is 8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid.
What is the SMILES notation for 8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid?
The canonical SMILES for 8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid is CC1CCCN(c2nccn3cc(C(=O)O)nc23)C1.
What is the InChIKey of 8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid?
The InChIKey is KJJSNVIIJDLSIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-9-3-2-5-16(7-9)11-12-15-10(13(18)19)8-17(12)6-4-14-11/h4,6,8-9H,2-3,5,7H2,1H3,(H,18,19).
What are the key properties of 8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid?
8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid has a molecular weight of 260.30 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyrazine-2-carboxylic acid is sourced from PubChem (CID 166334168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).