4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine

C13H8Cl2N2O2 — CID 43335962

IUPAC4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine
SMILESNc1onc(-c2ccco2)c1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C13H8Cl2N2O2/c14-7-3-4-8(9(15)6-7)11-12(17-19-13(11)16)10-2-1-5-18-10/h1-6H,16H2
InChIKeyZRLNDZZEFKVGOG-UHFFFAOYSA-N
MW295.12 g/mol
LogP4.49
Rot. Bonds2

About 4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine

4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine (PubChem CID 43335962) has the molecular formula C13H8Cl2N2O2 and a molecular weight of 295.12 g/mol. Its IUPAC name is 4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine
PubChem CID43335962
Molecular FormulaC13H8Cl2N2O2
Molecular Weight295.12 g/mol
Exact Mass294.00
IUPAC Name4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine
SMILESNc1onc(-c2ccco2)c1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C13H8Cl2N2O2/c14-7-3-4-8(9(15)6-7)11-12(17-19-13(11)16)10-2-1-5-18-10/h1-6H,16H2
InChIKeyZRLNDZZEFKVGOG-UHFFFAOYSA-N
XLogP4.49
TPSA65.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.12
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2,4-dichlorophenyl)-3-(2-methyl-4-pyridinyl)-1,2-oxazol-5-amine
CID 106753195
4-(2,4-dichlorophenyl)-3-(5-methylthiophen-2-yl)-1,2-oxazol-5-amine
CID 43335989
4-(2,4-dichlorophenyl)-3-(2,5-dimethylfuran-3-yl)-1,2-oxazol-5-amine
CID 43335963
[3-(2,4-dichlorophenyl)-5-(furan-2-yl)-1,2-oxazol-4-yl]methanol
CID 131868310
3-(2-bromo-4-chlorophenyl)-4-(2-chlorophenyl)-1,2-oxazol-5-amine
CID 107988958
4-(4-bromophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine
CID 43158061
4-(2-chloro-4-fluorophenyl)-3-(3-chlorophenyl)-1,2-oxazol-5-amine
CID 63036543
2-(2,4,6-trichlorophenyl)furan
CID 91803022
4-(2,4-dichlorophenyl)-3-heptan-4-yl-1,2-oxazol-5-amine
CID 82989478
3-(2-bromo-4-chlorophenyl)-4-(2-bromophenyl)-1,2-oxazol-5-amine
CID 107988970
3-(4-chloro-2-fluorophenyl)-4-phenyl-1,2-oxazol-5-amine
CID 43335730
2-amino-6-(2,4-dichlorophenyl)-4-(furan-2-yl)-5-methylpyridine-3-carbonitrile
CID 3339403

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine?
The IUPAC name of 4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine (CID 43335962) is 4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine?
The canonical SMILES for 4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine is Nc1onc(-c2ccco2)c1-c1ccc(Cl)cc1Cl.
What is the InChIKey of 4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine?
The InChIKey is ZRLNDZZEFKVGOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2N2O2/c14-7-3-4-8(9(15)6-7)11-12(17-19-13(11)16)10-2-1-5-18-10/h1-6H,16H2.
What are the key properties of 4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine?
4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine has a molecular weight of 295.12 g/mol, XLogP of 4.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dichlorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine is sourced from PubChem (CID 43335962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).