methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate

C14H16ClN3O2 — CID 117254631

IUPACmethyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate
SMILESCOC(=O)c1nc(C2CCNCC2)n2cccc(Cl)c12
InChIInChI=1S/C14H16ClN3O2/c1-20-14(19)11-12-10(15)3-2-8-18(12)13(17-11)9-4-6-16-7-5-9/h2-3,8-9,16H,4-7H2,1H3
InChIKeyNRQQIMDWURNBTP-UHFFFAOYSA-N
MW293.75 g/mol
LogP2.24
Rot. Bonds2

About methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate

methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate (PubChem CID 117254631) has the molecular formula C14H16ClN3O2 and a molecular weight of 293.75 g/mol. Its IUPAC name is methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate.

Molecular Properties

Compound Namemethyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate
PubChem CID117254631
Molecular FormulaC14H16ClN3O2
Molecular Weight293.75 g/mol
Exact Mass293.09
IUPAC Namemethyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate
SMILESCOC(=O)c1nc(C2CCNCC2)n2cccc(Cl)c12
InChIInChI=1S/C14H16ClN3O2/c1-20-14(19)11-12-10(15)3-2-8-18(12)13(17-11)9-4-6-16-7-5-9/h2-3,8-9,16H,4-7H2,1H3
InChIKeyNRQQIMDWURNBTP-UHFFFAOYSA-N
XLogP2.24
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.75
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-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-(azetidin-3-yl)-8-bromoimidazo[1,5-a]pyridine-1-carboxylate
CID 117254652
methyl 3-pyrrolidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate
CID 117252886
methyl 8-amino-3-(azepan-3-yl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117254701
methyl 1-chloro-3-(thian-4-yl)imidazo[1,5-a]pyridine-8-carboxylate
CID 117252222
methyl 6-methoxy-3-pyrrolidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate
CID 117253518
methyl 8-amino-3-(pyrrolidin-3-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117254781
1-bromo-3-piperidin-4-ylimidazo[1,5-a]pyridin-8-amine
CID 117252248
methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate
CID 117136001
methyl 3-(azetidin-3-ylmethyl)-8-hydroxyimidazo[1,5-a]pyridine-1-carboxylate
CID 117254749
methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate
CID 117254082
8-chloro-3-(piperazin-1-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117255609
5-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117252845

Frequently Asked Questions

What is the IUPAC name of methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate?
The IUPAC name of methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate (CID 117254631) is methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate.
What is the SMILES notation for methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate?
The canonical SMILES for methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate is COC(=O)c1nc(C2CCNCC2)n2cccc(Cl)c12.
What is the InChIKey of methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate?
The InChIKey is NRQQIMDWURNBTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3O2/c1-20-14(19)11-12-10(15)3-2-8-18(12)13(17-11)9-4-6-16-7-5-9/h2-3,8-9,16H,4-7H2,1H3.
What are the key properties of methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate?
methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate has a molecular weight of 293.75 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 8-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylate is sourced from PubChem (CID 117254631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).