2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid

C13H19N3O2 — CID 117157168

IUPAC2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid
SMILESO=C(O)C1CCCn2cc(C3CCCNC3)nc21
InChIInChI=1S/C13H19N3O2/c17-13(18)10-4-2-6-16-8-11(15-12(10)16)9-3-1-5-14-7-9/h8-10,14H,1-7H2,(H,17,18)
InChIKeyNCTMWMUDBHSWHB-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.31
Rot. Bonds2

About 2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid

2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid (PubChem CID 117157168) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid
PubChem CID117157168
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid
SMILESO=C(O)C1CCCn2cc(C3CCCNC3)nc21
InChIInChI=1S/C13H19N3O2/c17-13(18)10-4-2-6-16-8-11(15-12(10)16)9-3-1-5-14-7-9/h8-10,14H,1-7H2,(H,17,18)
InChIKeyNCTMWMUDBHSWHB-UHFFFAOYSA-N
XLogP1.31
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylic acid
CID 117155961
3-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylic acid
CID 117151926
2-(4-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid
CID 115003515
2-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid
CID 117157283
(7R)-7-methyl-2-[(3S)-piperidin-3-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 129462523
2-pyrrolidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 82604310
9-methyl-2-piperidin-3-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 115054823
(2-cyclopentyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanol
CID 117157569
(8R)-2-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine
CID 96629769
(3S)-3-(1,4-dimethylimidazol-2-yl)piperidine
CID 96743464
2-piperidin-3-yl-1,3-thiazole-5-carboxylic acid
CID 105466008
2-[(1-ethylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid
CID 117157242

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid?
The IUPAC name of 2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid (CID 117157168) is 2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid?
The canonical SMILES for 2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid is O=C(O)C1CCCn2cc(C3CCCNC3)nc21.
What is the InChIKey of 2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid?
The InChIKey is NCTMWMUDBHSWHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c17-13(18)10-4-2-6-16-8-11(15-12(10)16)9-3-1-5-14-7-9/h8-10,14H,1-7H2,(H,17,18).
What are the key properties of 2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid?
2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid has a molecular weight of 249.31 g/mol, XLogP of 1.31, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 117157168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).