5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine

C15H15N5OS — CID 28926040

IUPAC5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine
SMILESCc1csc(CNc2ccc(-c3nc(C4CC4)no3)cn2)n1
InChIInChI=1S/C15H15N5OS/c1-9-8-22-13(18-9)7-17-12-5-4-11(6-16-12)15-19-14(20-21-15)10-2-3-10/h4-6,8,10H,2-3,7H2,1H3,(H,16,17)
InChIKeyWKJDCFQBTOWTTH-UHFFFAOYSA-N
MW313.39 g/mol
LogP3.39
Rot. Bonds5

About 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine

5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine (PubChem CID 28926040) has the molecular formula C15H15N5OS and a molecular weight of 313.39 g/mol. Its IUPAC name is 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine
PubChem CID28926040
Molecular FormulaC15H15N5OS
Molecular Weight313.39 g/mol
Exact Mass313.10
IUPAC Name5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine
SMILESCc1csc(CNc2ccc(-c3nc(C4CC4)no3)cn2)n1
InChIInChI=1S/C15H15N5OS/c1-9-8-22-13(18-9)7-17-12-5-4-11(6-16-12)15-19-14(20-21-15)10-2-3-10/h4-6,8,10H,2-3,7H2,1H3,(H,16,17)
InChIKeyWKJDCFQBTOWTTH-UHFFFAOYSA-N
XLogP3.39
TPSA76.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.39
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine 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 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine?
The IUPAC name of 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine (CID 28926040) is 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine is Cc1csc(CNc2ccc(-c3nc(C4CC4)no3)cn2)n1.
What is the InChIKey of 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine?
The InChIKey is WKJDCFQBTOWTTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5OS/c1-9-8-22-13(18-9)7-17-12-5-4-11(6-16-12)15-19-14(20-21-15)10-2-3-10/h4-6,8,10H,2-3,7H2,1H3,(H,16,17).
What are the key properties of 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine?
5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine has a molecular weight of 313.39 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 28926040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).