4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine

C14H18N2O2 — CID 82086131

IUPAC4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine
SMILESCOCCc1noc(N)c1-c1ccc(C)cc1C
InChIInChI=1S/C14H18N2O2/c1-9-4-5-11(10(2)8-9)13-12(6-7-17-3)16-18-14(13)15/h4-5,8H,6-7,15H2,1-3H3
InChIKeyJUIILBNXPSORPR-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.73
Rot. Bonds4

About 4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine

4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine (PubChem CID 82086131) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine
PubChem CID82086131
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine
SMILESCOCCc1noc(N)c1-c1ccc(C)cc1C
InChIInChI=1S/C14H18N2O2/c1-9-4-5-11(10(2)8-9)13-12(6-7-17-3)16-18-14(13)15/h4-5,8H,6-7,15H2,1-3H3
InChIKeyJUIILBNXPSORPR-UHFFFAOYSA-N
XLogP2.73
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 ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-chloro-4-fluorophenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine
CID 63038642
methyl 5-amino-4-(2,4-dimethylphenyl)-1,2-oxazole-3-carboxylate
CID 82086058
5-amino-4-(2,4-dimethylphenyl)-1,2-oxazole-3-carboxylic acid
CID 82082347
4-(2,5-dimethylphenyl)-3-ethyl-1,2-oxazol-5-amine
CID 82078789
3-(2,4-dimethylphenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine
CID 43335592
4-(2-methoxy-5-methylphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine
CID 43335915
4-(2,4-dimethylphenyl)-5-methyl-1,2-oxazol-3-amine
CID 82469635
3-butyl-4-(2,4,6-trimethylphenyl)-1,2-oxazol-5-amine
CID 82089595
4-(2-methylphenyl)-3-pentyl-1,2-oxazol-5-amine
CID 43157921
4-ethyl-3-(2-methoxyethyl)-1,2-oxazol-5-amine
CID 43670965
4-(4-chlorophenyl)-3-(2,4-dimethylphenyl)-1,2-oxazol-5-amine
CID 43335821
methyl 5-amino-4-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxylate
CID 82086057

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine?
The IUPAC name of 4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine (CID 82086131) is 4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine?
The canonical SMILES for 4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine is COCCc1noc(N)c1-c1ccc(C)cc1C.
What is the InChIKey of 4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine?
The InChIKey is JUIILBNXPSORPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-9-4-5-11(10(2)8-9)13-12(6-7-17-3)16-18-14(13)15/h4-5,8H,6-7,15H2,1-3H3.
What are the key properties of 4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine?
4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine has a molecular weight of 246.31 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethylphenyl)-3-(2-methoxyethyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 82086131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).