N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide

C15H20N4O2S — CID 53167529

IUPACN-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide
SMILESCCc1noc(-c2csc(C(=O)NC3CCCCCC3)n2)n1
InChIInChI=1S/C15H20N4O2S/c1-2-12-18-14(21-19-12)11-9-22-15(17-11)13(20)16-10-7-5-3-4-6-8-10/h9-10H,2-8H2,1H3,(H,16,20)
InChIKeyKKWXWJDARHBYSU-UHFFFAOYSA-N
MW320.42 g/mol
LogP3.21
Rot. Bonds4

About N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide

N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide (PubChem CID 53167529) has the molecular formula C15H20N4O2S and a molecular weight of 320.42 g/mol. Its IUPAC name is N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide
PubChem CID53167529
Molecular FormulaC15H20N4O2S
Molecular Weight320.42 g/mol
Exact Mass320.13
IUPAC NameN-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide
SMILESCCc1noc(-c2csc(C(=O)NC3CCCCCC3)n2)n1
InChIInChI=1S/C15H20N4O2S/c1-2-12-18-14(21-19-12)11-9-22-15(17-11)13(20)16-10-7-5-3-4-6-8-10/h9-10H,2-8H2,1H3,(H,16,20)
InChIKeyKKWXWJDARHBYSU-UHFFFAOYSA-N
XLogP3.21
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.42
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-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-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide?
The IUPAC name of N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide (CID 53167529) is N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide?
The canonical SMILES for N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide is CCc1noc(-c2csc(C(=O)NC3CCCCCC3)n2)n1.
What is the InChIKey of N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide?
The InChIKey is KKWXWJDARHBYSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2S/c1-2-12-18-14(21-19-12)11-9-22-15(17-11)13(20)16-10-7-5-3-4-6-8-10/h9-10H,2-8H2,1H3,(H,16,20).
What are the key properties of N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide?
N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide has a molecular weight of 320.42 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 53167529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).