5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine

C16H13F4N5O — CID 167776957

IUPAC5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine
SMILESFc1ccc(-c2cn3c(n2)CCC(Nc2nnc(C(F)F)o2)C3)c(F)c1
InChIInChI=1S/C16H13F4N5O/c17-8-1-3-10(11(18)5-8)12-7-25-6-9(2-4-13(25)22-12)21-16-24-23-15(26-16)14(19)20/h1,3,5,7,9,14H,2,4,6H2,(H,21,24)
InChIKeyWYKPBLNKNASFOQ-UHFFFAOYSA-N
MW367.31 g/mol
LogP3.58
Rot. Bonds4

About 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine

5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine (PubChem CID 167776957) has the molecular formula C16H13F4N5O and a molecular weight of 367.31 g/mol. Its IUPAC name is 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine
PubChem CID167776957
Molecular FormulaC16H13F4N5O
Molecular Weight367.31 g/mol
Exact Mass367.11
IUPAC Name5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine
SMILESFc1ccc(-c2cn3c(n2)CCC(Nc2nnc(C(F)F)o2)C3)c(F)c1
InChIInChI=1S/C16H13F4N5O/c17-8-1-3-10(11(18)5-8)12-7-25-6-9(2-4-13(25)22-12)21-16-24-23-15(26-16)14(19)20/h1,3,5,7,9,14H,2,4,6H2,(H,21,24)
InChIKeyWYKPBLNKNASFOQ-UHFFFAOYSA-N
XLogP3.58
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.31
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine (CID 167776957) is 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine is Fc1ccc(-c2cn3c(n2)CCC(Nc2nnc(C(F)F)o2)C3)c(F)c1.
What is the InChIKey of 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine?
The InChIKey is WYKPBLNKNASFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F4N5O/c17-8-1-3-10(11(18)5-8)12-7-25-6-9(2-4-13(25)22-12)21-16-24-23-15(26-16)14(19)20/h1,3,5,7,9,14H,2,4,6H2,(H,21,24).
What are the key properties of 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine?
5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine has a molecular weight of 367.31 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethyl)-N-[2-(2,4-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 167776957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).