4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine

C14H18N2O2 — CID 43158239

IUPAC4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine
SMILESCOc1ccccc1-c1c(CC(C)C)noc1N
InChIInChI=1S/C14H18N2O2/c1-9(2)8-11-13(14(15)18-16-11)10-6-4-5-7-12(10)17-3/h4-7,9H,8,15H2,1-3H3
InChIKeyBMHASXYMSNZZHW-UHFFFAOYSA-N
MW246.31 g/mol
LogP3.13
Rot. Bonds4

About 4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine

4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine (PubChem CID 43158239) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine
PubChem CID43158239
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine
SMILESCOc1ccccc1-c1c(CC(C)C)noc1N
InChIInChI=1S/C14H18N2O2/c1-9(2)8-11-13(14(15)18-16-11)10-6-4-5-7-12(10)17-3/h4-7,9H,8,15H2,1-3H3
InChIKeyBMHASXYMSNZZHW-UHFFFAOYSA-N
XLogP3.13
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-methoxy-5-methylphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine
CID 43335915
4-(3-chloro-2-fluorophenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine
CID 82802668
3-[2-(furan-2-yl)ethyl]-4-(2-methoxyphenyl)-1,2-oxazol-5-amine
CID 43158243
4-(2-methoxyphenyl)-3-(3-methoxythiophen-2-yl)-1,2-oxazol-5-amine
CID 81122324
4-(2-bromophenyl)-3-(2-methylbutyl)-1,2-oxazol-5-amine
CID 114875139
4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine
CID 114877509
3-ethyl-4-(5-fluoro-2-methoxyphenyl)-1,2-oxazol-5-amine
CID 82083559
4-(2-methoxyphenyl)-5-(2,3,3-trimethylbutyl)-1,2-oxazol-3-amine
CID 66198768
[4-(2-methoxyphenyl)-5-methyl-1,2-oxazol-3-yl]methanol
CID 174708303
4-(2-bromophenyl)-3-(3-methylbutyl)-1,2-oxazol-5-amine
CID 62830518
3-cycloheptyl-4-(2-methoxyphenyl)-1,2-oxazol-5-amine
CID 62588706
3-(3-iodophenyl)-4-(2-methoxyphenyl)-1,2-oxazol-5-amine
CID 43336010

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine?
The IUPAC name of 4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine (CID 43158239) is 4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine?
The canonical SMILES for 4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine is COc1ccccc1-c1c(CC(C)C)noc1N.
What is the InChIKey of 4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine?
The InChIKey is BMHASXYMSNZZHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-9(2)8-11-13(14(15)18-16-11)10-6-4-5-7-12(10)17-3/h4-7,9H,8,15H2,1-3H3.
What are the key properties of 4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine?
4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine has a molecular weight of 246.31 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 43158239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).