2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid

C14H18N4O2 — CID 103385128

IUPAC2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid
SMILESCn1cnc2c(N3CCC(CC(=O)O)CC3)nccc21
InChIInChI=1S/C14H18N4O2/c1-17-9-16-13-11(17)2-5-15-14(13)18-6-3-10(4-7-18)8-12(19)20/h2,5,9-10H,3-4,6-8H2,1H3,(H,19,20)
InChIKeyILEJKAPHERXRDK-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.66
Rot. Bonds3

About 2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid

2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid (PubChem CID 103385128) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid.

Molecular Properties

Compound Name2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid
PubChem CID103385128
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid
SMILESCn1cnc2c(N3CCC(CC(=O)O)CC3)nccc21
InChIInChI=1S/C14H18N4O2/c1-17-9-16-13-11(17)2-5-15-14(13)18-6-3-10(4-7-18)8-12(19)20/h2,5,9-10H,3-4,6-8H2,1H3,(H,19,20)
InChIKeyILEJKAPHERXRDK-UHFFFAOYSA-N
XLogP1.66
TPSA71.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid?
The IUPAC name of 2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid (CID 103385128) is 2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid.
What is the SMILES notation for 2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid?
The canonical SMILES for 2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid is Cn1cnc2c(N3CCC(CC(=O)O)CC3)nccc21.
What is the InChIKey of 2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid?
The InChIKey is ILEJKAPHERXRDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-17-9-16-13-11(17)2-5-15-14(13)18-6-3-10(4-7-18)8-12(19)20/h2,5,9-10H,3-4,6-8H2,1H3,(H,19,20).
What are the key properties of 2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid?
2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid has a molecular weight of 274.32 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidin-4-yl]acetic acid is sourced from PubChem (CID 103385128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).