N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide

C18H24N2O3S — CID 102557927

IUPACN-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide
SMILESCCOC1CC(N(C)C(=O)c2nc(-c3ccco3)sc2C)C1(C)C
InChIInChI=1S/C18H24N2O3S/c1-6-22-14-10-13(18(14,3)4)20(5)17(21)15-11(2)24-16(19-15)12-8-7-9-23-12/h7-9,13-14H,6,10H2,1-5H3
InChIKeyVHMHGOXEPNYQFG-UHFFFAOYSA-N
MW348.47 g/mol
LogP3.99
Rot. Bonds5

About N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide

N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide (PubChem CID 102557927) has the molecular formula C18H24N2O3S and a molecular weight of 348.47 g/mol. Its IUPAC name is N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide
PubChem CID102557927
Molecular FormulaC18H24N2O3S
Molecular Weight348.47 g/mol
Exact Mass348.15
IUPAC NameN-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide
SMILESCCOC1CC(N(C)C(=O)c2nc(-c3ccco3)sc2C)C1(C)C
InChIInChI=1S/C18H24N2O3S/c1-6-22-14-10-13(18(14,3)4)20(5)17(21)15-11(2)24-16(19-15)12-8-7-9-23-12/h7-9,13-14H,6,10H2,1-5H3
InChIKeyVHMHGOXEPNYQFG-UHFFFAOYSA-N
XLogP3.99
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.47
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-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-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide (CID 102557927) is N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide is CCOC1CC(N(C)C(=O)c2nc(-c3ccco3)sc2C)C1(C)C.
What is the InChIKey of N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide?
The InChIKey is VHMHGOXEPNYQFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3S/c1-6-22-14-10-13(18(14,3)4)20(5)17(21)15-11(2)24-16(19-15)12-8-7-9-23-12/h7-9,13-14H,6,10H2,1-5H3.
What are the key properties of N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide?
N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide has a molecular weight of 348.47 g/mol, XLogP of 3.99, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-(furan-2-yl)-N,5-dimethyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 102557927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).