ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate

C15H19N3O2 — CID 165131768

IUPACethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate
SMILESCCOC(=O)Cc1cc(C2CC2)cn2cc(CN)nc12
InChIInChI=1S/C15H19N3O2/c1-2-20-14(19)6-11-5-12(10-3-4-10)8-18-9-13(7-16)17-15(11)18/h5,8-10H,2-4,6-7,16H2,1H3
InChIKeyFQFFFWVEEJFOPX-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.78
Rot. Bonds5

About ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate

ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate (PubChem CID 165131768) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate
PubChem CID165131768
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Nameethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate
SMILESCCOC(=O)Cc1cc(C2CC2)cn2cc(CN)nc12
InChIInChI=1S/C15H19N3O2/c1-2-20-14(19)6-11-5-12(10-3-4-10)8-18-9-13(7-16)17-15(11)18/h5,8-10H,2-4,6-7,16H2,1H3
InChIKeyFQFFFWVEEJFOPX-UHFFFAOYSA-N
XLogP1.78
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate?
The IUPAC name of ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate (CID 165131768) is ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate.
What is the SMILES notation for ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate?
The canonical SMILES for ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate is CCOC(=O)Cc1cc(C2CC2)cn2cc(CN)nc12.
What is the InChIKey of ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate?
The InChIKey is FQFFFWVEEJFOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-20-14(19)6-11-5-12(10-3-4-10)8-18-9-13(7-16)17-15(11)18/h5,8-10H,2-4,6-7,16H2,1H3.
What are the key properties of ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate?
ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate has a molecular weight of 273.34 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-(aminomethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]acetate is sourced from PubChem (CID 165131768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).