2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid

C14H18N4O2 — CID 103385168

IUPAC2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid
SMILESCn1cnc2c(N3CCCCC3(C)C(=O)O)nccc21
InChIInChI=1S/C14H18N4O2/c1-14(13(19)20)6-3-4-8-18(14)12-11-10(5-7-15-12)17(2)9-16-11/h5,7,9H,3-4,6,8H2,1-2H3,(H,19,20)
InChIKeyOXWZABPHNWYGKV-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.80
Rot. Bonds2

About 2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid

2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid (PubChem CID 103385168) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid.

Molecular Properties

Compound Name2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid
PubChem CID103385168
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid
SMILESCn1cnc2c(N3CCCCC3(C)C(=O)O)nccc21
InChIInChI=1S/C14H18N4O2/c1-14(13(19)20)6-3-4-8-18(14)12-11-10(5-7-15-12)17(2)9-16-11/h5,7,9H,3-4,6,8H2,1-2H3,(H,19,20)
InChIKeyOXWZABPHNWYGKV-UHFFFAOYSA-N
XLogP1.80
TPSA71.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid?
The IUPAC name of 2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid (CID 103385168) is 2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid.
What is the SMILES notation for 2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid?
The canonical SMILES for 2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid is Cn1cnc2c(N3CCCCC3(C)C(=O)O)nccc21.
What is the InChIKey of 2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid?
The InChIKey is OXWZABPHNWYGKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-14(13(19)20)6-3-4-8-18(14)12-11-10(5-7-15-12)17(2)9-16-11/h5,7,9H,3-4,6,8H2,1-2H3,(H,19,20).
What are the key properties of 2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid?
2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid has a molecular weight of 274.32 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(1-methylimidazo[4,5-c]pyridin-4-yl)piperidine-2-carboxylic acid is sourced from PubChem (CID 103385168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).