2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine

C29H24F2N6 — CID 164616244

IUPAC2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine
SMILESCN(C)CCn1cc(-c2ccc3c(-c4cnc5ccc(-c6cc(F)ccc6F)cn45)ccnc3c2)cn1
InChIInChI=1S/C29H24F2N6/c1-35(2)11-12-36-17-21(15-34-36)19-3-6-23-24(9-10-32-27(23)13-19)28-16-33-29-8-4-20(18-37(28)29)25-14-22(30)5-7-26(25)31/h3-10,13-18H,11-12H2,1-2H3
InChIKeyMPNFOPVBSVHOOE-UHFFFAOYSA-N
MW494.55 g/mol
LogP5.92
Rot. Bonds6

About 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine

2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine (PubChem CID 164616244) has the molecular formula C29H24F2N6 and a molecular weight of 494.55 g/mol. Its IUPAC name is 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine
PubChem CID164616244
Molecular FormulaC29H24F2N6
Molecular Weight494.55 g/mol
Exact Mass494.20
IUPAC Name2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine
SMILESCN(C)CCn1cc(-c2ccc3c(-c4cnc5ccc(-c6cc(F)ccc6F)cn45)ccnc3c2)cn1
InChIInChI=1S/C29H24F2N6/c1-35(2)11-12-36-17-21(15-34-36)19-3-6-23-24(9-10-32-27(23)13-19)28-16-33-29-8-4-20(18-37(28)29)25-14-22(30)5-7-26(25)31/h3-10,13-18H,11-12H2,1-2H3
InChIKeyMPNFOPVBSVHOOE-UHFFFAOYSA-N
XLogP5.92
TPSA51.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.55
LogP ≤ 55.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine 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 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine?
The IUPAC name of 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine (CID 164616244) is 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine?
The canonical SMILES for 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine is CN(C)CCn1cc(-c2ccc3c(-c4cnc5ccc(-c6cc(F)ccc6F)cn45)ccnc3c2)cn1.
What is the InChIKey of 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine?
The InChIKey is MPNFOPVBSVHOOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24F2N6/c1-35(2)11-12-36-17-21(15-34-36)19-3-6-23-24(9-10-32-27(23)13-19)28-16-33-29-8-4-20(18-37(28)29)25-14-22(30)5-7-26(25)31/h3-10,13-18H,11-12H2,1-2H3.
What are the key properties of 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine?
2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine has a molecular weight of 494.55 g/mol, XLogP of 5.92, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-[6-(2,5-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]quinolin-7-yl]pyrazol-1-yl]-N,N-dimethylethanamine is sourced from PubChem (CID 164616244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).