N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide

C15H19N3O2S — CID 53161972

IUPACN-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide
SMILESO=C(Cc1nnc(-c2cccs2)o1)NC1CCCCCC1
InChIInChI=1S/C15H19N3O2S/c19-13(16-11-6-3-1-2-4-7-11)10-14-17-18-15(20-14)12-8-5-9-21-12/h5,8-9,11H,1-4,6-7,10H2,(H,16,19)
InChIKeyILPSYZXDRXPBJT-UHFFFAOYSA-N
MW305.40 g/mol
LogP3.18
Rot. Bonds4

About N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide

N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide (PubChem CID 53161972) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide
PubChem CID53161972
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC NameN-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide
SMILESO=C(Cc1nnc(-c2cccs2)o1)NC1CCCCCC1
InChIInChI=1S/C15H19N3O2S/c19-13(16-11-6-3-1-2-4-7-11)10-14-17-18-15(20-14)12-8-5-9-21-12/h5,8-9,11H,1-4,6-7,10H2,(H,16,19)
InChIKeyILPSYZXDRXPBJT-UHFFFAOYSA-N
XLogP3.18
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 ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The IUPAC name of N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide (CID 53161972) is N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide.
What is the SMILES notation for N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The canonical SMILES for N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide is O=C(Cc1nnc(-c2cccs2)o1)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The InChIKey is ILPSYZXDRXPBJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c19-13(16-11-6-3-1-2-4-7-11)10-14-17-18-15(20-14)12-8-5-9-21-12/h5,8-9,11H,1-4,6-7,10H2,(H,16,19).
What are the key properties of N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide has a molecular weight of 305.40 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide is sourced from PubChem (CID 53161972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).