methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate

C14H17N3O3 — CID 117254082

IUPACmethyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate
SMILESCOC(=O)c1nc(C2CCCNC2)n2ccc(O)cc12
InChIInChI=1S/C14H17N3O3/c1-20-14(19)12-11-7-10(18)4-6-17(11)13(16-12)9-3-2-5-15-8-9/h4,6-7,9,15,18H,2-3,5,8H2,1H3
InChIKeyLEOQEQWPHPDUBX-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.29
Rot. Bonds2

About methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate

methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate (PubChem CID 117254082) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate.

Molecular Properties

Compound Namemethyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate
PubChem CID117254082
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Namemethyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate
SMILESCOC(=O)c1nc(C2CCCNC2)n2ccc(O)cc12
InChIInChI=1S/C14H17N3O3/c1-20-14(19)12-11-7-10(18)4-6-17(11)13(16-12)9-3-2-5-15-8-9/h4,6-7,9,15,18H,2-3,5,8H2,1H3
InChIKeyLEOQEQWPHPDUBX-UHFFFAOYSA-N
XLogP1.29
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-bromo-3-piperidin-3-ylimidazo[1,5-a]pyridin-7-ol
CID 117254078
methyl 3-pyrrolidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate
CID 117252886
3-(azepan-3-yl)-7-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117254101
methyl 3-(azepan-3-yl)-6-methylimidazo[1,5-a]pyridine-1-carboxylate
CID 117253559
methyl 7-methoxy-3-pyrrolidin-2-ylimidazo[1,5-a]pyridine-1-carboxylate
CID 117254222
methyl 8-amino-3-(azepan-3-yl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117254701
methyl 6-methoxy-3-pyrrolidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate
CID 117253518
methyl 3-(azepan-3-yl)-5-methoxyimidazo[1,5-a]pyridine-1-carboxylate
CID 117252914
1-bromo-3-piperidin-3-ylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 84744775
3-pyrrolidin-3-ylimidazo[1,5-a]pyridine-1,7-dicarboxylic acid
CID 117251581
7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117251690
methyl 2-piperidin-3-ylimidazo[1,2-a]pyridine-7-carboxylate
CID 117134090

Frequently Asked Questions

What is the IUPAC name of methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate?
The IUPAC name of methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate (CID 117254082) is methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate.
What is the SMILES notation for methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate?
The canonical SMILES for methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate is COC(=O)c1nc(C2CCCNC2)n2ccc(O)cc12.
What is the InChIKey of methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate?
The InChIKey is LEOQEQWPHPDUBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-20-14(19)12-11-7-10(18)4-6-17(11)13(16-12)9-3-2-5-15-8-9/h4,6-7,9,15,18H,2-3,5,8H2,1H3.
What are the key properties of methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate?
methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate has a molecular weight of 275.31 g/mol, XLogP of 1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 7-hydroxy-3-piperidin-3-ylimidazo[1,5-a]pyridine-1-carboxylate is sourced from PubChem (CID 117254082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).