4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine

C15H20N2O2 — CID 116832495

IUPAC4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine
SMILESCNc1nc(-c2cc(C(C)C)c(OC)cc2C)co1
InChIInChI=1S/C15H20N2O2/c1-9(2)11-7-12(10(3)6-14(11)18-5)13-8-19-15(16-4)17-13/h6-9H,1-5H3,(H,16,17)
InChIKeyVHUMRQRNNCYBRB-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.82
Rot. Bonds4

About 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine

4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine (PubChem CID 116832495) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine.

Molecular Properties

Compound Name4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine
PubChem CID116832495
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine
SMILESCNc1nc(-c2cc(C(C)C)c(OC)cc2C)co1
InChIInChI=1S/C15H20N2O2/c1-9(2)11-7-12(10(3)6-14(11)18-5)13-8-19-15(16-4)17-13/h6-9H,1-5H3,(H,16,17)
InChIKeyVHUMRQRNNCYBRB-UHFFFAOYSA-N
XLogP3.82
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(5-chloro-4-methoxy-2-methylphenyl)-N-methyl-1,3-oxazol-2-amine
CID 116832501
4-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1,3-oxazol-2-amine
CID 116832537
[4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-2-yl]hydrazine
CID 39103679
5-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-3-methyl-1,2-oxazole
CID 116868925
4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-6-methyl-1,3,5-triazin-2-amine
CID 96668566
1-[5-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-1H-imidazol-2-yl]-N-methylmethanamine
CID 95475764
(4-methoxy-2-methyl-5-propan-2-ylphenyl)-(methylamino)methanol
CID 116954652
1-[4-(4-ethoxy-2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-2-yl]-N-methylethanamine
CID 3647690
3-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methylpropan-1-amine
CID 95452248
1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethylhydrazine
CID 82473084
5-(2,4-dimethoxy-5-propan-2-ylphenyl)-1,3-oxazole
CID 68972183
5-(4-methoxy-5-methyl-2-propan-2-ylphenoxy)-2-N-methylpyrimidine-2,4-diamine
CID 149414681

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine?
The IUPAC name of 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine (CID 116832495) is 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine.
What is the SMILES notation for 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine?
The canonical SMILES for 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine is CNc1nc(-c2cc(C(C)C)c(OC)cc2C)co1.
What is the InChIKey of 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine?
The InChIKey is VHUMRQRNNCYBRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-9(2)11-7-12(10(3)6-14(11)18-5)13-8-19-15(16-4)17-13/h6-9H,1-5H3,(H,16,17).
What are the key properties of 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine?
4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine has a molecular weight of 260.34 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methyl-1,3-oxazol-2-amine is sourced from PubChem (CID 116832495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).