3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine

C12H14N2O2 — CID 62505613

IUPAC3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine
SMILESCOc1ccc(C)cc1-c1noc(N)c1C
InChIInChI=1S/C12H14N2O2/c1-7-4-5-10(15-3)9(6-7)11-8(2)12(13)16-14-11/h4-6H,13H2,1-3H3
InChIKeyKBKYUYOZMDUJSR-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.55
Rot. Bonds2

About 3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine

3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine (PubChem CID 62505613) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine
PubChem CID62505613
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine
SMILESCOc1ccc(C)cc1-c1noc(N)c1C
InChIInChI=1S/C12H14N2O2/c1-7-4-5-10(15-3)9(6-7)11-8(2)12(13)16-14-11/h4-6H,13H2,1-3H3
InChIKeyKBKYUYOZMDUJSR-UHFFFAOYSA-N
XLogP2.55
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(5-bromo-2-methoxyphenyl)-4-methyl-1,2-oxazol-5-amine
CID 82134756
4-ethyl-3-(2-methoxy-5-methylphenyl)-1,2-oxazol-5-amine
CID 62505793
3-(2-methoxy-5-methylphenyl)-4-pyridin-3-yl-1,2-oxazol-5-amine
CID 80522526
4-(2-methoxy-5-methylphenyl)-3-thiophen-3-yl-1,2-oxazol-5-amine
CID 43335925
4-(2-methoxy-5-methylphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine
CID 43335915
3-(2,6-dimethoxyphenyl)-4-methyl-1,2-oxazol-5-amine
CID 43158389
4-(2-methoxy-5-methylphenyl)-6-methylpyrimidin-5-amine
CID 82391060
5-(2-methoxy-5-methylphenyl)-1,2-thiazol-3-amine
CID 83910475
5-(chloromethyl)-3-(2-methoxy-5-methylphenyl)-1,2,4-oxadiazole
CID 145064896
5-(2-methoxy-5-methylphenyl)-1H-imidazol-4-amine
CID 82469801
3-[5-(2-methoxy-5-methylphenyl)-1,2,4-oxadiazol-3-yl]pentan-3-amine
CID 62505441
4-(2-methoxy-5-methylphenyl)-6-methylpyrimidin-2-amine
CID 62482749

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine?
The IUPAC name of 3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine (CID 62505613) is 3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine?
The canonical SMILES for 3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine is COc1ccc(C)cc1-c1noc(N)c1C.
What is the InChIKey of 3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine?
The InChIKey is KBKYUYOZMDUJSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-7-4-5-10(15-3)9(6-7)11-8(2)12(13)16-14-11/h4-6H,13H2,1-3H3.
What are the key properties of 3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine?
3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine has a molecular weight of 218.26 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine is sourced from PubChem (CID 62505613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).