N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide

C15H19N3O2S — CID 53140766

IUPACN-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide
SMILESCc1sc(-c2nnc(C(C)C)o2)cc1NC(=O)C1CCC1
InChIInChI=1S/C15H19N3O2S/c1-8(2)14-17-18-15(20-14)12-7-11(9(3)21-12)16-13(19)10-5-4-6-10/h7-8,10H,4-6H2,1-3H3,(H,16,19)
InChIKeyFKSWQMPTXXUPGF-UHFFFAOYSA-N
MW305.40 g/mol
LogP3.97
Rot. Bonds4

About N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide

N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide (PubChem CID 53140766) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide
PubChem CID53140766
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC NameN-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide
SMILESCc1sc(-c2nnc(C(C)C)o2)cc1NC(=O)C1CCC1
InChIInChI=1S/C15H19N3O2S/c1-8(2)14-17-18-15(20-14)12-7-11(9(3)21-12)16-13(19)10-5-4-6-10/h7-8,10H,4-6H2,1-3H3,(H,16,19)
InChIKeyFKSWQMPTXXUPGF-UHFFFAOYSA-N
XLogP3.97
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide 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-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide?
The IUPAC name of N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide (CID 53140766) is N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide.
What is the SMILES notation for N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide?
The canonical SMILES for N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide is Cc1sc(-c2nnc(C(C)C)o2)cc1NC(=O)C1CCC1.
What is the InChIKey of N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide?
The InChIKey is FKSWQMPTXXUPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-8(2)14-17-18-15(20-14)12-7-11(9(3)21-12)16-13(19)10-5-4-6-10/h7-8,10H,4-6H2,1-3H3,(H,16,19).
What are the key properties of N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide?
N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide has a molecular weight of 305.40 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]cyclobutanecarboxamide is sourced from PubChem (CID 53140766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).