4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid

C13H16N4O2 — CID 68647071

IUPAC4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid
SMILESCc1cn2c(N3CCN(C(=O)O)CC3)cccc2n1
InChIInChI=1S/C13H16N4O2/c1-10-9-17-11(14-10)3-2-4-12(17)15-5-7-16(8-6-15)13(18)19/h2-4,9H,5-8H2,1H3,(H,18,19)
InChIKeySONKVHIXTIKDCT-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.44
Rot. Bonds1

About 4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid

4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid (PubChem CID 68647071) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid.

Molecular Properties

Compound Name4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid
PubChem CID68647071
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid
SMILESCc1cn2c(N3CCN(C(=O)O)CC3)cccc2n1
InChIInChI=1S/C13H16N4O2/c1-10-9-17-11(14-10)3-2-4-12(17)15-5-7-16(8-6-15)13(18)19/h2-4,9H,5-8H2,1H3,(H,18,19)
InChIKeySONKVHIXTIKDCT-UHFFFAOYSA-N
XLogP1.44
TPSA61.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid?
The IUPAC name of 4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid (CID 68647071) is 4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid.
What is the SMILES notation for 4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid?
The canonical SMILES for 4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid is Cc1cn2c(N3CCN(C(=O)O)CC3)cccc2n1.
What is the InChIKey of 4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid?
The InChIKey is SONKVHIXTIKDCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-10-9-17-11(14-10)3-2-4-12(17)15-5-7-16(8-6-15)13(18)19/h2-4,9H,5-8H2,1H3,(H,18,19).
What are the key properties of 4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid?
4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid has a molecular weight of 260.30 g/mol, XLogP of 1.44, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylimidazo[1,2-a]pyridin-5-yl)piperazine-1-carboxylic acid is sourced from PubChem (CID 68647071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).