ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate

C15H19N3O3 — CID 57436228

IUPACethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1nc(CN2CCOCC2)c2ccccn12
InChIInChI=1S/C15H19N3O3/c1-2-21-15(19)14-16-12(11-17-7-9-20-10-8-17)13-5-3-4-6-18(13)14/h3-6H,2,7-11H2,1H3
InChIKeyRPCSDZTVISGZMW-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.34
Rot. Bonds4

About ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate

ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate (PubChem CID 57436228) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate
PubChem CID57436228
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC Nameethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1nc(CN2CCOCC2)c2ccccn12
InChIInChI=1S/C15H19N3O3/c1-2-21-15(19)14-16-12(11-17-7-9-20-10-8-17)13-5-3-4-6-18(13)14/h3-6H,2,7-11H2,1H3
InChIKeyRPCSDZTVISGZMW-UHFFFAOYSA-N
XLogP1.34
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate?
The IUPAC name of ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate (CID 57436228) is ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate.
What is the SMILES notation for ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate?
The canonical SMILES for ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate is CCOC(=O)c1nc(CN2CCOCC2)c2ccccn12.
What is the InChIKey of ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate?
The InChIKey is RPCSDZTVISGZMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-2-21-15(19)14-16-12(11-17-7-9-20-10-8-17)13-5-3-4-6-18(13)14/h3-6H,2,7-11H2,1H3.
What are the key properties of ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate?
ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate has a molecular weight of 289.34 g/mol, XLogP of 1.34, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate is sourced from PubChem (CID 57436228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).