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

C12H10N2O2S — CID 114821375

IUPAC3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine
SMILESCc1cc(-c2noc(N)c2-c2cccs2)co1
InChIInChI=1S/C12H10N2O2S/c1-7-5-8(6-15-7)11-10(12(13)16-14-11)9-3-2-4-17-9/h2-6H,13H2,1H3
InChIKeyQPQSCFPJRLWQND-UHFFFAOYSA-N
MW246.29 g/mol
LogP3.55
Rot. Bonds2

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

3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine (PubChem CID 114821375) has the molecular formula C12H10N2O2S and a molecular weight of 246.29 g/mol. Its IUPAC name is 3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine
PubChem CID114821375
Molecular FormulaC12H10N2O2S
Molecular Weight246.29 g/mol
Exact Mass246.05
IUPAC Name3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine
SMILESCc1cc(-c2noc(N)c2-c2cccs2)co1
InChIInChI=1S/C12H10N2O2S/c1-7-5-8(6-15-7)11-10(12(13)16-14-11)9-3-2-4-17-9/h2-6H,13H2,1H3
InChIKeyQPQSCFPJRLWQND-UHFFFAOYSA-N
XLogP3.55
TPSA65.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(Furan-2-yl)-2-methylsulfanyl-5-(1,2-oxazol-3-yl)thiophene-3-carbonitrile
CID 2821095
4-(4-Fluorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine
CID 43158142
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-(3-Fluorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine
CID 43336034
4-(2-Fluorophenyl)-3-(furan-3-yl)-1,2-oxazol-5-amine
CID 54978054
4-(2-Fluorophenyl)-3-(2-methylfuran-3-yl)-1,2-oxazol-5-amine
CID 61553070
3-[2-(Difluoromethoxy)phenyl]-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 62500701
3-[3-(Difluoromethoxy)phenyl]-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 62503084
3-(3-Fluoro-4-methoxyphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 62919392
3-(2-Fluoro-6-methoxyphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 65433067
4-(4-Fluorophenyl)-3-(4-methoxythiophen-2-yl)-1,2-oxazol-5-amine
CID 81121607

Frequently Asked Questions

What is the IUPAC name of 3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine?
The IUPAC name of 3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine (CID 114821375) is 3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine?
The canonical SMILES for 3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine is Cc1cc(-c2noc(N)c2-c2cccs2)co1.
What is the InChIKey of 3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine?
The InChIKey is QPQSCFPJRLWQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O2S/c1-7-5-8(6-15-7)11-10(12(13)16-14-11)9-3-2-4-17-9/h2-6H,13H2,1H3.
What are the key properties of 3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine?
3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine has a molecular weight of 246.29 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylfuran-3-yl)-4-thiophen-2-yl-1,2-oxazol-5-amine is sourced from PubChem (CID 114821375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).