N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide

C23H19N5O4S — CID 23144365

IUPACN-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide
SMILESO=C(Nc1nc(-c2ccco2)c(C(=O)c2ccc(N3CCOCC3)nc2)s1)c1ccncc1
InChIInChI=1S/C23H19N5O4S/c29-20(16-3-4-18(25-14-16)28-9-12-31-13-10-28)21-19(17-2-1-11-32-17)26-23(33-21)27-22(30)15-5-7-24-8-6-15/h1-8,11,14H,9-10,12-13H2,(H,26,27,30)
InChIKeyGFWSSJATZKVLOB-UHFFFAOYSA-N
MW461.50 g/mol
LogP3.51
Rot. Bonds6

About N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide

N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide (PubChem CID 23144365) has the molecular formula C23H19N5O4S and a molecular weight of 461.50 g/mol. Its IUPAC name is N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide
PubChem CID23144365
Molecular FormulaC23H19N5O4S
Molecular Weight461.50 g/mol
Exact Mass461.12
IUPAC NameN-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide
SMILESO=C(Nc1nc(-c2ccco2)c(C(=O)c2ccc(N3CCOCC3)nc2)s1)c1ccncc1
InChIInChI=1S/C23H19N5O4S/c29-20(16-3-4-18(25-14-16)28-9-12-31-13-10-28)21-19(17-2-1-11-32-17)26-23(33-21)27-22(30)15-5-7-24-8-6-15/h1-8,11,14H,9-10,12-13H2,(H,26,27,30)
InChIKeyGFWSSJATZKVLOB-UHFFFAOYSA-N
XLogP3.51
TPSA110.45 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.50
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-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-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide?
The IUPAC name of N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide (CID 23144365) is N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide.
What is the SMILES notation for N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide?
The canonical SMILES for N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide is O=C(Nc1nc(-c2ccco2)c(C(=O)c2ccc(N3CCOCC3)nc2)s1)c1ccncc1.
What is the InChIKey of N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide?
The InChIKey is GFWSSJATZKVLOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N5O4S/c29-20(16-3-4-18(25-14-16)28-9-12-31-13-10-28)21-19(17-2-1-11-32-17)26-23(33-21)27-22(30)15-5-7-24-8-6-15/h1-8,11,14H,9-10,12-13H2,(H,26,27,30).
What are the key properties of N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide?
N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide has a molecular weight of 461.50 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-yl)-5-(6-morpholin-4-ylpyridine-3-carbonyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide is sourced from PubChem (CID 23144365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).