N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide

C23H20N6O2S — CID 170129039

IUPACN-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide
SMILESCc1cc(-c2sc(NC(=O)N3CCOCC3)nc2-c2cccc(C#N)c2)cn2ccnc12
InChIInChI=1S/C23H20N6O2S/c1-15-11-18(14-29-6-5-25-21(15)29)20-19(17-4-2-3-16(12-17)13-24)26-22(32-20)27-23(30)28-7-9-31-10-8-28/h2-6,11-12,14H,7-10H2,1H3,(H,26,27,30)
InChIKeyYRYREAKRBQGPQO-UHFFFAOYSA-N
MW444.52 g/mol
LogP4.17
Rot. Bonds3

About N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide

N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide (PubChem CID 170129039) has the molecular formula C23H20N6O2S and a molecular weight of 444.52 g/mol. Its IUPAC name is N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide
PubChem CID170129039
Molecular FormulaC23H20N6O2S
Molecular Weight444.52 g/mol
Exact Mass444.14
IUPAC NameN-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide
SMILESCc1cc(-c2sc(NC(=O)N3CCOCC3)nc2-c2cccc(C#N)c2)cn2ccnc12
InChIInChI=1S/C23H20N6O2S/c1-15-11-18(14-29-6-5-25-21(15)29)20-19(17-4-2-3-16(12-17)13-24)26-22(32-20)27-23(30)28-7-9-31-10-8-28/h2-6,11-12,14H,7-10H2,1H3,(H,26,27,30)
InChIKeyYRYREAKRBQGPQO-UHFFFAOYSA-N
XLogP4.17
TPSA95.55 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.52
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide 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 N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide?
The IUPAC name of N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide (CID 170129039) is N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide.
What is the SMILES notation for N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide?
The canonical SMILES for N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide is Cc1cc(-c2sc(NC(=O)N3CCOCC3)nc2-c2cccc(C#N)c2)cn2ccnc12.
What is the InChIKey of N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide?
The InChIKey is YRYREAKRBQGPQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N6O2S/c1-15-11-18(14-29-6-5-25-21(15)29)20-19(17-4-2-3-16(12-17)13-24)26-22(32-20)27-23(30)28-7-9-31-10-8-28/h2-6,11-12,14H,7-10H2,1H3,(H,26,27,30).
What are the key properties of N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide?
N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide has a molecular weight of 444.52 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-cyanophenyl)-5-(8-methylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]morpholine-4-carboxamide is sourced from PubChem (CID 170129039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).