N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide

C120H137N21O9S8 — CID 159375524

IUPACN-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
SMILESCC(=O)C1(N2CCOCC2)CCN(c2ccccc2NC(=O)c2csc(-c3cn[nH]c3)n2)CC1.CCCC1CCCN(c2c(NC(=O)c3csc(-c4cccs4)n3)ccc3ccccc23)C1.CCCC1CCCN(c2cc(CC(N)=O)ccc2NC(=O)c2csc(-c3cccs3)n2)C1.CCCC1CCCN(c2ccc(OC)cc2NC(=O)c2csc(-c3cccs3)n2)C1.O=C(Nc1ccccc1N1CCC2(CCCCC2)CC1)c1csc(-c2cn[nH]c2)n1
InChIInChI=1S/C26H27N3OS2.C24H28N6O3S.C24H28N4O2S2.C23H27N5OS.C23H27N3O2S2/c1-2-7-18-8-5-14-29(16-18)24-20-10-4-3-9-19(20)12-13-21(24)27-25(30)22-17-32-26(28-22)23-11-6-15-31-23;1-17(31)24(30-10-12-33-13-11-30)6-8-29(9-7-24)21-5-3-2-4-19(21)27-22(32)20-16-34-23(28-20)18-14-25-26-15-18;1-2-5-16-6-3-10-28(14-16)20-12-17(13-22(25)29)8-9-18(20)26-23(30)19-15-32-24(27-19)21-7-4-11-31-21;29-21(19-16-30-22(27-19)17-14-24-25-15-17)26-18-6-2-3-7-20(18)28-12-10-23(11-13-28)8-4-1-5-9-23;1-3-6-16-7-4-11-26(14-16)20-10-9-17(28-2)13-18(20)24-22(27)19-15-30-23(25-19)21-8-5-12-29-21/h3-4,6,9-13,15,17-18H,2,5,7-8,14,16H2,1H3,(H,27,30);2-5,14-16H,6-13H2,1H3,(H,25,26)(H,27,32);4,7-9,11-12,15-16H,2-3,5-6,10,13-14H2,1H3,(H2,25,29)(H,26,30);2-3,6-7,14-16H,1,4-5,8-13H2,(H,24,25)(H,26,29);5,8-10,12-13,15-16H,3-4,6-7,11,14H2,1-2H3,(H,24,27)
InChIKeyLKGMXKQZSRCADT-UHFFFAOYSA-N
MW2274.09 g/mol
LogP26.99
Rot. Bonds31

About N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide

N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide (PubChem CID 159375524) has the molecular formula C120H137N21O9S8 and a molecular weight of 2274.09 g/mol. Its IUPAC name is N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
PubChem CID159375524
Molecular FormulaC120H137N21O9S8
Molecular Weight2274.09 g/mol
Exact Mass2271.87
IUPAC NameN-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
SMILESCC(=O)C1(N2CCOCC2)CCN(c2ccccc2NC(=O)c2csc(-c3cn[nH]c3)n2)CC1.CCCC1CCCN(c2c(NC(=O)c3csc(-c4cccs4)n3)ccc3ccccc23)C1.CCCC1CCCN(c2cc(CC(N)=O)ccc2NC(=O)c2csc(-c3cccs3)n2)C1.CCCC1CCCN(c2ccc(OC)cc2NC(=O)c2csc(-c3cccs3)n2)C1.O=C(Nc1ccccc1N1CCC2(CCCCC2)CC1)c1csc(-c2cn[nH]c2)n1
InChIInChI=1S/C26H27N3OS2.C24H28N6O3S.C24H28N4O2S2.C23H27N5OS.C23H27N3O2S2/c1-2-7-18-8-5-14-29(16-18)24-20-10-4-3-9-19(20)12-13-21(24)27-25(30)22-17-32-26(28-22)23-11-6-15-31-23;1-17(31)24(30-10-12-33-13-11-30)6-8-29(9-7-24)21-5-3-2-4-19(21)27-22(32)20-16-34-23(28-20)18-14-25-26-15-18;1-2-5-16-6-3-10-28(14-16)20-12-17(13-22(25)29)8-9-18(20)26-23(30)19-15-32-24(27-19)21-7-4-11-31-21;29-21(19-16-30-22(27-19)17-14-24-25-15-17)26-18-6-2-3-7-20(18)28-12-10-23(11-13-28)8-4-1-5-9-23;1-3-6-16-7-4-11-26(14-16)20-10-9-17(28-2)13-18(20)24-22(27)19-15-30-23(25-19)21-8-5-12-29-21/h3-4,6,9-13,15,17-18H,2,5,7-8,14,16H2,1H3,(H,27,30);2-5,14-16H,6-13H2,1H3,(H,25,26)(H,27,32);4,7-9,11-12,15-16H,2-3,5-6,10,13-14H2,1H3,(H2,25,29)(H,26,30);2-3,6-7,14-16H,1,4-5,8-13H2,(H,24,25)(H,26,29);5,8-10,12-13,15-16H,3-4,6-7,11,14H2,1-2H3,(H,24,27)
InChIKeyLKGMXKQZSRCADT-UHFFFAOYSA-N
XLogP26.99
TPSA365.37 Ų
H-Bond Donors8
H-Bond Acceptors30
Rotatable Bonds31
Heavy Atoms158
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002274.09
LogP ≤ 526.99
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide (CID 159375524) is N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide is CC(=O)C1(N2CCOCC2)CCN(c2ccccc2NC(=O)c2csc(-c3cn[nH]c3)n2)CC1.CCCC1CCCN(c2c(NC(=O)c3csc(-c4cccs4)n3)ccc3ccccc23)C1.CCCC1CCCN(c2cc(CC(N)=O)ccc2NC(=O)c2csc(-c3cccs3)n2)C1.CCCC1CCCN(c2ccc(OC)cc2NC(=O)c2csc(-c3cccs3)n2)C1.O=C(Nc1ccccc1N1CCC2(CCCCC2)CC1)c1csc(-c2cn[nH]c2)n1.
What is the InChIKey of N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
The InChIKey is LKGMXKQZSRCADT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N3OS2.C24H28N6O3S.C24H28N4O2S2.C23H27N5OS.C23H27N3O2S2/c1-2-7-18-8-5-14-29(16-18)24-20-10-4-3-9-19(20)12-13-21(24)27-25(30)22-17-32-26(28-22)23-11-6-15-31-23;1-17(31)24(30-10-12-33-13-11-30)6-8-29(9-7-24)21-5-3-2-4-19(21)27-22(32)20-16-34-23(28-20)18-14-25-26-15-18;1-2-5-16-6-3-10-28(14-16)20-12-17(13-22(25)29)8-9-18(20)26-23(30)19-15-32-24(27-19)21-7-4-11-31-21;29-21(19-16-30-22(27-19)17-14-24-25-15-17)26-18-6-2-3-7-20(18)28-12-10-23(11-13-28)8-4-1-5-9-23;1-3-6-16-7-4-11-26(14-16)20-10-9-17(28-2)13-18(20)24-22(27)19-15-30-23(25-19)21-8-5-12-29-21/h3-4,6,9-13,15,17-18H,2,5,7-8,14,16H2,1H3,(H,27,30);2-5,14-16H,6-13H2,1H3,(H,25,26)(H,27,32);4,7-9,11-12,15-16H,2-3,5-6,10,13-14H2,1H3,(H2,25,29)(H,26,30);2-3,6-7,14-16H,1,4-5,8-13H2,(H,24,25)(H,26,29);5,8-10,12-13,15-16H,3-4,6-7,11,14H2,1-2H3,(H,24,27).
What are the key properties of N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide has a molecular weight of 2274.09 g/mol, XLogP of 26.99, 31 rotatable bonds, 8 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-acetyl-4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[4-(2-amino-2-oxoethyl)-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[2-(3-azaspiro[5.5]undecan-3-yl)phenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide;N-[5-methoxy-2-(3-propylpiperidin-1-yl)phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;N-[1-(3-propylpiperidin-1-yl)naphthalen-2-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 159375524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).