methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate

C16H21N3O2 — CID 117140246

IUPACmethyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate
SMILESCOC(=O)c1ccc2cnc(CC3CCCCN3C)n2c1
InChIInChI=1S/C16H21N3O2/c1-18-8-4-3-5-13(18)9-15-17-10-14-7-6-12(11-19(14)15)16(20)21-2/h6-7,10-11,13H,3-5,8-9H2,1-2H3
InChIKeyNUSCBDUKAAONSH-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.15
Rot. Bonds3

About methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate

methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate (PubChem CID 117140246) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate.

Molecular Properties

Compound Namemethyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate
PubChem CID117140246
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Namemethyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate
SMILESCOC(=O)c1ccc2cnc(CC3CCCCN3C)n2c1
InChIInChI=1S/C16H21N3O2/c1-18-8-4-3-5-13(18)9-15-17-10-14-7-6-12(11-19(14)15)16(20)21-2/h6-7,10-11,13H,3-5,8-9H2,1-2H3
InChIKeyNUSCBDUKAAONSH-UHFFFAOYSA-N
XLogP2.15
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 3-[(1-ethylpyrrolidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate
CID 117140229
methyl 3-[(1-methylpyrrolidin-2-yl)methyl]imidazo[1,5-a]pyridine-8-carboxylate
CID 117147575
methyl 2-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate
CID 117129873
methyl 3-(1-methylpiperidin-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate
CID 117140201
3-(thian-2-ylmethyl)imidazo[1,5-a]pyridine-6-carboxylic acid
CID 117140239
methyl 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridine-7-carboxylate
CID 117145337
6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid
CID 65471120
3-(oxan-3-ylmethyl)imidazo[1,5-a]pyridine-6-carboxylic acid
CID 117140259
3-[(1-ethylpyrrolidin-2-yl)methyl]-6-methoxyimidazo[1,5-a]pyridine
CID 117137995
methyl 2-[(1-methylpiperidin-2-yl)methylamino]-1,3-thiazole-5-carboxylate
CID 80571000
3-[2-(4-methylpiperazin-1-yl)ethyl]imidazo[1,5-a]pyridine-6-carboxylic acid
CID 117140371
methyl 4-[(1-methylpiperidin-2-yl)methylamino]pyridine-2-carboxylate
CID 66285860

Frequently Asked Questions

What is the IUPAC name of methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate?
The IUPAC name of methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate (CID 117140246) is methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate.
What is the SMILES notation for methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate?
The canonical SMILES for methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate is COC(=O)c1ccc2cnc(CC3CCCCN3C)n2c1.
What is the InChIKey of methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate?
The InChIKey is NUSCBDUKAAONSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-18-8-4-3-5-13(18)9-15-17-10-14-7-6-12(11-19(14)15)16(20)21-2/h6-7,10-11,13H,3-5,8-9H2,1-2H3.
What are the key properties of methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate?
methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate has a molecular weight of 287.36 g/mol, XLogP of 2.15, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-[(1-methylpiperidin-2-yl)methyl]imidazo[1,5-a]pyridine-6-carboxylate is sourced from PubChem (CID 117140246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).