3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine

C16H16N2O3 — CID 43158243

IUPAC3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine
SMILESCOc1ccccc1-c1c(CCc2ccco2)noc1N
InChIInChI=1S/C16H16N2O3/c1-19-14-7-3-2-6-12(14)15-13(18-21-16(15)17)9-8-11-5-4-10-20-11/h2-7,10H,8-9,17H2,1H3
InChIKeyLOTNQBVPTXHPHN-UHFFFAOYSA-N
MW284.31 g/mol
LogP3.31
Rot. Bonds5

About 3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine

3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine (PubChem CID 43158243) has the molecular formula C16H16N2O3 and a molecular weight of 284.31 g/mol. Its IUPAC name is 3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine
PubChem CID43158243
Molecular FormulaC16H16N2O3
Molecular Weight284.31 g/mol
Exact Mass284.12
IUPAC Name3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine
SMILESCOc1ccccc1-c1c(CCc2ccco2)noc1N
InChIInChI=1S/C16H16N2O3/c1-19-14-7-3-2-6-12(14)15-13(18-21-16(15)17)9-8-11-5-4-10-20-11/h2-7,10H,8-9,17H2,1H3
InChIKeyLOTNQBVPTXHPHN-UHFFFAOYSA-N
XLogP3.31
TPSA74.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine
CID 43158239
4-(3-chlorophenyl)-3-[2-(furan-2-yl)ethyl]-1,2-oxazol-5-amine
CID 43335623
4-(2-methoxyphenyl)-3-(3-methoxythiophen-2-yl)-1,2-oxazol-5-amine
CID 81122324
3-ethyl-4-(5-fluoro-2-methoxyphenyl)-1,2-oxazol-5-amine
CID 82083559
[4-(2-methoxyphenyl)-5-methyl-1,2-oxazol-3-yl]methanol
CID 174708303
3-cycloheptyl-4-(2-methoxyphenyl)-1,2-oxazol-5-amine
CID 62588706
4-(5-chloro-2-methoxyphenyl)-3-pentyl-1,2-oxazol-5-amine
CID 43336106
3-(3-iodophenyl)-4-(2-methoxyphenyl)-1,2-oxazol-5-amine
CID 43336010
5-butyl-4-(2-methoxyphenyl)-1,2-oxazol-3-amine
CID 66200570
3-(2,6-dimethoxyphenyl)-4-methyl-1,2-oxazol-5-amine
CID 43158389
4-(2-bromophenyl)-3-(3-methylbutyl)-1,2-oxazol-5-amine
CID 62830518
4-(2-methylphenyl)-3-pentyl-1,2-oxazol-5-amine
CID 43157921

Frequently Asked Questions

What is the IUPAC name of 3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine?
The IUPAC name of 3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine (CID 43158243) is 3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine is COc1ccccc1-c1c(CCc2ccco2)noc1N.
What is the InChIKey of 3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine?
The InChIKey is LOTNQBVPTXHPHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-19-14-7-3-2-6-12(14)15-13(18-21-16(15)17)9-8-11-5-4-10-20-11/h2-7,10H,8-9,17H2,1H3.
What are the key properties of 3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine?
3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine has a molecular weight of 284.31 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 43158243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).