4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine

C14H11ClN2O2 — CID 43335614

IUPAC4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine
SMILESCc1occc1-c1noc(N)c1-c1cccc(Cl)c1
InChIInChI=1S/C14H11ClN2O2/c1-8-11(5-6-18-8)13-12(14(16)19-17-13)9-3-2-4-10(15)7-9/h2-7H,16H2,1H3
InChIKeyGXSLVTHGAUOOCL-UHFFFAOYSA-N
MW274.71 g/mol
LogP4.15
Rot. Bonds2

About 4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine

4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine (PubChem CID 43335614) has the molecular formula C14H11ClN2O2 and a molecular weight of 274.71 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine
PubChem CID43335614
Molecular FormulaC14H11ClN2O2
Molecular Weight274.71 g/mol
Exact Mass274.05
IUPAC Name4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine
SMILESCc1occc1-c1noc(N)c1-c1cccc(Cl)c1
InChIInChI=1S/C14H11ClN2O2/c1-8-11(5-6-18-8)13-12(14(16)19-17-13)9-3-2-4-10(15)7-9/h2-7H,16H2,1H3
InChIKeyGXSLVTHGAUOOCL-UHFFFAOYSA-N
XLogP4.15
TPSA65.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.71
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(5-Chlorofuran-2-yl)-4-phenyl-1,2-oxazol-5-amine
CID 76317763
2-(4-(5-Amino-3-(furan-3-yl)isoxazol-4-yl)phenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 10271802
4-(2-Chloro-6-fluorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine
CID 43157994
4-(4-Fluorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine
CID 43158142
3-(2,5-Dimethylfuran-3-yl)-4-(4-fluorophenyl)-1,2-oxazol-5-amine
CID 43158143
4-(4-Fluorophenyl)-3-(furan-3-yl)-1,2-oxazol-5-amine
CID 43158167
4-(3-Fluorophenyl)-3-(furan-3-yl)-1,2-oxazol-5-amine
CID 43158280
4-(2-Chloro-6-fluorophenyl)-3-(furan-2-yl)-1,2-oxazol-5-amine
CID 43335667
4-(2-Chloro-6-fluorophenyl)-3-(2,5-dimethylfuran-3-yl)-1,2-oxazol-5-amine
CID 43335668
4-(2-Chloro-6-fluorophenyl)-3-[2-(furan-2-yl)ethyl]-1,2-oxazol-5-amine
CID 43335677
4-(2-Chloro-6-fluorophenyl)-3-(5-methylfuran-2-yl)-1,2-oxazol-5-amine
CID 43335679
4-(2-Chloro-6-fluorophenyl)-3-(3-methylfuran-2-yl)-1,2-oxazol-5-amine
CID 43335680

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine?
The IUPAC name of 4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine (CID 43335614) is 4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine?
The canonical SMILES for 4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine is Cc1occc1-c1noc(N)c1-c1cccc(Cl)c1.
What is the InChIKey of 4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine?
The InChIKey is GXSLVTHGAUOOCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O2/c1-8-11(5-6-18-8)13-12(14(16)19-17-13)9-3-2-4-10(15)7-9/h2-7H,16H2,1H3.
What are the key properties of 4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine?
4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine has a molecular weight of 274.71 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine is sourced from PubChem (CID 43335614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).