ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate

C17H18N4O2 — CID 139487437

IUPACethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate
SMILESCCOC(=O)c1cnn(Cc2cn3cc(C4CC4)ccc3n2)c1
InChIInChI=1S/C17H18N4O2/c1-2-23-17(22)14-7-18-21(9-14)11-15-10-20-8-13(12-3-4-12)5-6-16(20)19-15/h5-10,12H,2-4,11H2,1H3
InChIKeyNZEXCPDVFLPBPZ-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.63
Rot. Bonds5

About ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate

ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate (PubChem CID 139487437) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate.

Molecular Properties

Compound Nameethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate
PubChem CID139487437
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC Nameethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate
SMILESCCOC(=O)c1cnn(Cc2cn3cc(C4CC4)ccc3n2)c1
InChIInChI=1S/C17H18N4O2/c1-2-23-17(22)14-7-18-21(9-14)11-15-10-20-8-13(12-3-4-12)5-6-16(20)19-15/h5-10,12H,2-4,11H2,1H3
InChIKeyNZEXCPDVFLPBPZ-UHFFFAOYSA-N
XLogP2.63
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate?
The IUPAC name of ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate (CID 139487437) is ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate.
What is the SMILES notation for ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate?
The canonical SMILES for ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate is CCOC(=O)c1cnn(Cc2cn3cc(C4CC4)ccc3n2)c1.
What is the InChIKey of ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate?
The InChIKey is NZEXCPDVFLPBPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-2-23-17(22)14-7-18-21(9-14)11-15-10-20-8-13(12-3-4-12)5-6-16(20)19-15/h5-10,12H,2-4,11H2,1H3.
What are the key properties of ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate?
ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate has a molecular weight of 310.36 g/mol, XLogP of 2.63, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-[(6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazole-4-carboxylate is sourced from PubChem (CID 139487437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).