8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid

C15H23N3O2 — CID 117249726

IUPAC8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCC1CCCn2c(C3CCN(C)CC3)nc(C(=O)O)c21
InChIInChI=1S/C15H23N3O2/c1-10-4-3-7-18-13(10)12(15(19)20)16-14(18)11-5-8-17(2)9-6-11/h10-11H,3-9H2,1-2H3,(H,19,20)
InChIKeyZFDCJCOIVVKWOZ-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.29
Rot. Bonds2

About 8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid

8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 117249726) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID117249726
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCC1CCCn2c(C3CCN(C)CC3)nc(C(=O)O)c21
InChIInChI=1S/C15H23N3O2/c1-10-4-3-7-18-13(10)12(15(19)20)16-14(18)11-5-8-17(2)9-6-11/h10-11H,3-9H2,1-2H3,(H,19,20)
InChIKeyZFDCJCOIVVKWOZ-UHFFFAOYSA-N
XLogP2.29
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid (CID 117249726) is 8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid is CC1CCCn2c(C3CCN(C)CC3)nc(C(=O)O)c21.
What is the InChIKey of 8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is ZFDCJCOIVVKWOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-10-4-3-7-18-13(10)12(15(19)20)16-14(18)11-5-8-17(2)9-6-11/h10-11H,3-9H2,1-2H3,(H,19,20).
What are the key properties of 8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?
8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 277.37 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-(1-methylpiperidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 117249726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).