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

C12H14N2O2 — CID 82079241

IUPAC4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine
SMILESCOc1ccc(-c2c(C)noc2N)cc1C
InChIInChI=1S/C12H14N2O2/c1-7-6-9(4-5-10(7)15-3)11-8(2)14-16-12(11)13/h4-6H,13H2,1-3H3
InChIKeyRPPMMPBGSQLBHU-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.55
Rot. Bonds2

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

4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine (PubChem CID 82079241) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine
PubChem CID82079241
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine
SMILESCOc1ccc(-c2c(C)noc2N)cc1C
InChIInChI=1S/C12H14N2O2/c1-7-6-9(4-5-10(7)15-3)11-8(2)14-16-12(11)13/h4-6H,13H2,1-3H3
InChIKeyRPPMMPBGSQLBHU-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

4-(3-chloro-4-methoxyphenyl)-3-methyl-1,2-oxazol-5-amine
CID 82084136
4-(3-ethyl-4-methoxyphenyl)-3-methyl-1,2-oxazol-5-amine
CID 82082412
5-(4-methoxy-3-methylphenyl)-1,2-oxazol-3-amine
CID 82112667
3-(2,2-dimethylpropyl)-4-(3-methoxy-4-methylphenyl)-1,2-oxazol-5-amine
CID 43158422
4-(3-methoxy-4-methylphenyl)-3-phenyl-1,2-oxazol-5-amine
CID 43336126
methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene
CID 161175155
4-(3-chloro-4-methoxyphenyl)-3-cyclopropyl-1,2-oxazol-5-amine
CID 82091592
4-[4-(difluoromethoxy)phenyl]-3-methyl-1,2-oxazol-5-amine
CID 43158134
1,2,3,4,5-pentafluoro-6-(4-methoxy-3-methylphenyl)benzene
CID 134628428
4-(3-fluoro-4-methoxyphenyl)-3-propan-2-yl-1,2-oxazol-5-amine
CID 82087354
(1R)-1-[3-(4-methoxy-3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropan-1-amine
CID 104901771
4-(3-chloro-4-methoxyphenyl)-3-propan-2-yl-1,2-oxazol-5-amine
CID 82092078

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine?
The IUPAC name of 4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine (CID 82079241) is 4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine?
The canonical SMILES for 4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine is COc1ccc(-c2c(C)noc2N)cc1C.
What is the InChIKey of 4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine?
The InChIKey is RPPMMPBGSQLBHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-7-6-9(4-5-10(7)15-3)11-8(2)14-16-12(11)13/h4-6H,13H2,1-3H3.
What are the key properties of 4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine?
4-(4-methoxy-3-methylphenyl)-3-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 4-(4-methoxy-3-methylphenyl)-3-methyl-1,2-oxazol-5-amine is sourced from PubChem (CID 82079241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).