2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine

C8H6F2N4O — CID 103436713

IUPAC2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine
SMILESNc1nnc(Nc2cccc(F)c2F)o1
InChIInChI=1S/C8H6F2N4O/c9-4-2-1-3-5(6(4)10)12-8-14-13-7(11)15-8/h1-3H,(H2,11,13)(H,12,14)
InChIKeyOGZASUYAQVQXBK-UHFFFAOYSA-N
MW212.16 g/mol
LogP1.67
Rot. Bonds2

About 2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine

2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine (PubChem CID 103436713) has the molecular formula C8H6F2N4O and a molecular weight of 212.16 g/mol. Its IUPAC name is 2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine.

Molecular Properties

Compound Name2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine
PubChem CID103436713
Molecular FormulaC8H6F2N4O
Molecular Weight212.16 g/mol
Exact Mass212.05
IUPAC Name2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine
SMILESNc1nnc(Nc2cccc(F)c2F)o1
InChIInChI=1S/C8H6F2N4O/c9-4-2-1-3-5(6(4)10)12-8-14-13-7(11)15-8/h1-3H,(H2,11,13)(H,12,14)
InChIKeyOGZASUYAQVQXBK-UHFFFAOYSA-N
XLogP1.67
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.16
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-aminoethyl)-N-(2,3-difluorophenyl)-1,3,4-oxadiazol-2-amine
CID 106969727
5-(1-chloroethyl)-N-(2,3-difluorophenyl)-1,3,4-oxadiazol-2-amine
CID 106956850
2-N-(2-bromophenyl)-1,3,4-oxadiazole-2,5-diamine
CID 103436573
N-(2,3-difluorophenyl)-5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-amine
CID 106969724
N-(2,3-difluorophenyl)-5-[1-(ethylamino)ethyl]-1,3,4-oxadiazol-2-amine
CID 106969735
2-N-(2-ethylphenyl)-1,3,4-oxadiazole-2,5-diamine
CID 103436588
5-(1-aminoethyl)-N-(3-fluoro-2-methylphenyl)-1,3,4-oxadiazol-2-amine
CID 106969926
2-N-(4-fluoro-2-methoxyphenyl)-1,3,4-oxadiazole-2,5-diamine
CID 103436829
1-N-(2,3-difluorophenyl)-2,6-difluorobenzene-1,4-diamine
CID 61076599
6-N-(2,3-difluorophenyl)pyridine-2,3,6-triamine
CID 79827013
N-(2-fluorophenyl)-5-(methylaminomethyl)-1,3,4-oxadiazol-2-amine
CID 106968128
2-N-(5-bromo-2-methylphenyl)-1,3,4-oxadiazole-2,5-diamine
CID 103436693

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine?
The IUPAC name of 2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine (CID 103436713) is 2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine.
What is the SMILES notation for 2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine?
The canonical SMILES for 2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine is Nc1nnc(Nc2cccc(F)c2F)o1.
What is the InChIKey of 2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine?
The InChIKey is OGZASUYAQVQXBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F2N4O/c9-4-2-1-3-5(6(4)10)12-8-14-13-7(11)15-8/h1-3H,(H2,11,13)(H,12,14).
What are the key properties of 2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine?
2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine has a molecular weight of 212.16 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,3-difluorophenyl)-1,3,4-oxadiazole-2,5-diamine is sourced from PubChem (CID 103436713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).