1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one

C25H29N5O — CID 127039450

IUPAC1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one
SMILESCCCCC(=O)c1cc(-c2cccc3nccn23)c2cc(N3CCN(C)CC3)ccn12
InChIInChI=1S/C25H29N5O/c1-3-4-7-24(31)23-18-20(21-6-5-8-25-26-10-12-30(21)25)22-17-19(9-11-29(22)23)28-15-13-27(2)14-16-28/h5-6,8-12,17-18H,3-4,7,13-16H2,1-2H3
InChIKeyPTVVMHUYKQVJJE-UHFFFAOYSA-N
MW415.54 g/mol
LogP4.38
Rot. Bonds6

About 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one

1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one (PubChem CID 127039450) has the molecular formula C25H29N5O and a molecular weight of 415.54 g/mol. Its IUPAC name is 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one.

Molecular Properties

Compound Name1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one
PubChem CID127039450
Molecular FormulaC25H29N5O
Molecular Weight415.54 g/mol
Exact Mass415.24
IUPAC Name1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one
SMILESCCCCC(=O)c1cc(-c2cccc3nccn23)c2cc(N3CCN(C)CC3)ccn12
InChIInChI=1S/C25H29N5O/c1-3-4-7-24(31)23-18-20(21-6-5-8-25-26-10-12-30(21)25)22-17-19(9-11-29(22)23)28-15-13-27(2)14-16-28/h5-6,8-12,17-18H,3-4,7,13-16H2,1-2H3
InChIKeyPTVVMHUYKQVJJE-UHFFFAOYSA-N
XLogP4.38
TPSA45.26 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.54
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one 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 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one?
The IUPAC name of 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one (CID 127039450) is 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one.
What is the SMILES notation for 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one?
The canonical SMILES for 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one is CCCCC(=O)c1cc(-c2cccc3nccn23)c2cc(N3CCN(C)CC3)ccn12.
What is the InChIKey of 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one?
The InChIKey is PTVVMHUYKQVJJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N5O/c1-3-4-7-24(31)23-18-20(21-6-5-8-25-26-10-12-30(21)25)22-17-19(9-11-29(22)23)28-15-13-27(2)14-16-28/h5-6,8-12,17-18H,3-4,7,13-16H2,1-2H3.
What are the key properties of 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one?
1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one has a molecular weight of 415.54 g/mol, XLogP of 4.38, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-imidazo[1,2-a]pyridin-5-yl-7-(4-methylpiperazin-1-yl)indolizin-3-yl]pentan-1-one is sourced from PubChem (CID 127039450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).