6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide

C25H30N4O3S — CID 129017223

IUPAC6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2c(-c3cnc(N(C)C)s3)cc(C3CCCCC3)[nH]c2=O)cc1
InChIInChI=1S/C25H30N4O3S/c1-4-32-18-12-10-17(11-13-18)27-23(30)22-19(21-15-26-25(33-21)29(2)3)14-20(28-24(22)31)16-8-6-5-7-9-16/h10-16H,4-9H2,1-3H3,(H,27,30)(H,28,31)
InChIKeyIGMKAHASEOKXEM-UHFFFAOYSA-N
MW466.61 g/mol
LogP5.26
Rot. Bonds7

About 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide

6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 129017223) has the molecular formula C25H30N4O3S and a molecular weight of 466.61 g/mol. Its IUPAC name is 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID129017223
Molecular FormulaC25H30N4O3S
Molecular Weight466.61 g/mol
Exact Mass466.20
IUPAC Name6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2c(-c3cnc(N(C)C)s3)cc(C3CCCCC3)[nH]c2=O)cc1
InChIInChI=1S/C25H30N4O3S/c1-4-32-18-12-10-17(11-13-18)27-23(30)22-19(21-15-26-25(33-21)29(2)3)14-20(28-24(22)31)16-8-6-5-7-9-16/h10-16H,4-9H2,1-3H3,(H,27,30)(H,28,31)
InChIKeyIGMKAHASEOKXEM-UHFFFAOYSA-N
XLogP5.26
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.61
LogP ≤ 55.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-cyclohexyl-N-(4-ethoxyphenyl)-5-fluoro-4-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 129050853
6-cyclohexyl-4-(1-cyclopropylpyrazol-4-yl)-2-oxo-N-[4-(trifluoromethoxy)phenyl]-1H-pyridine-3-carboxamide;ethane
CID 144977544
3-acetyl-6-(4-butoxyphenyl)-4-(4-tert-butylphenyl)-1H-pyridin-2-one;6-(4-butoxyphenyl)-4-(4-tert-butylphenyl)-N-cyclopropylsulfonyl-2-oxo-1H-pyridine-3-carboxamide;4-[2-(dimethylamino)-1,3-thiazol-5-yl]-6-(1-fluorocyclohexyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4-[2-(dimethylamino)-1,3-thiazol-5-yl]-6-(1-hydroxycyclohexyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 158760933
4-[4-(dimethylamino)phenyl]-N-(4-ethoxyphenyl)-6-(1-fluorocyclohexyl)-2-oxo-1H-pyridine-3-carboxamide
CID 129050888
4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide
CID 116667999
N-(4-cyclopentyloxyphenyl)-4-ethoxybenzamide
CID 36565370
1-cyclopropyl-N-(4-ethoxyphenyl)-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 36705199
6-(cyclohexylamino)-N-(4-ethoxyphenyl)pyrimidine-4-carboxamide
CID 109341918
N-(4-ethoxyphenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607524
(6R)-N-(4-ethoxyphenyl)-6-methyl-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
CID 95397492
N-(4-ethoxyphenyl)-4-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 110650319
4-ethoxy-N-[4-[(3R)-piperidin-3-yl]phenyl]benzamide
CID 124566261

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide (CID 129017223) is 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide is CCOc1ccc(NC(=O)c2c(-c3cnc(N(C)C)s3)cc(C3CCCCC3)[nH]c2=O)cc1.
What is the InChIKey of 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is IGMKAHASEOKXEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N4O3S/c1-4-32-18-12-10-17(11-13-18)27-23(30)22-19(21-15-26-25(33-21)29(2)3)14-20(28-24(22)31)16-8-6-5-7-9-16/h10-16H,4-9H2,1-3H3,(H,27,30)(H,28,31).
What are the key properties of 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide?
6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 466.61 g/mol, XLogP of 5.26, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-4-[2-(dimethylamino)-1,3-thiazol-5-yl]-N-(4-ethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 129017223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).