2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline

C11H12N2O2 — CID 82469941

IUPAC2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline
SMILESCOc1cc(-c2ncc(C)o2)ccc1N
InChIInChI=1S/C11H12N2O2/c1-7-6-13-11(15-7)8-3-4-9(12)10(5-8)14-2/h3-6H,12H2,1-2H3
InChIKeyAKFDUVKOLGRRIA-UHFFFAOYSA-N
MW204.23 g/mol
LogP2.24
Rot. Bonds2

About 2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline

2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline (PubChem CID 82469941) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline.

Molecular Properties

Compound Name2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline
PubChem CID82469941
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline
SMILESCOc1cc(-c2ncc(C)o2)ccc1N
InChIInChI=1S/C11H12N2O2/c1-7-6-13-11(15-7)8-3-4-9(12)10(5-8)14-2/h3-6H,12H2,1-2H3
InChIKeyAKFDUVKOLGRRIA-UHFFFAOYSA-N
XLogP2.24
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-4-(1,3-oxazol-2-yl)aniline
CID 82468773
3-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline
CID 82469943
4-(4-amino-3-methoxyphenyl)-2-methoxyaniline;benzene
CID 157477717
2-methoxy-4-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzene-1,4-diamine
CID 114182306
5-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]-2-methylaniline
CID 143054394
2-methoxy-4-(5-propyl-1,3,4-oxadiazol-2-yl)aniline
CID 104783442
4-[2-(3,4-dimethoxyphenyl)-1,3-oxazol-5-yl]benzene-1,2-diol
CID 70799802
4-(4-amino-3-methoxyphenyl)-2-methoxyaniline;5H-tetrazole
CID 175609219
2-amino-5-(4-amino-3-methoxyphenyl)phenol
CID 131862396
2-methyl-4-(5-propan-2-yl-1,3-oxazol-2-yl)aniline
CID 64865344
4-(1,5-dimethylpyrazol-3-yl)-2-methoxyaniline
CID 134456084
4-(4,5-dimethyl-1,2,4-triazol-3-yl)-2-methoxyaniline
CID 82472145

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline?
The IUPAC name of 2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline (CID 82469941) is 2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline.
What is the SMILES notation for 2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline?
The canonical SMILES for 2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline is COc1cc(-c2ncc(C)o2)ccc1N.
What is the InChIKey of 2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline?
The InChIKey is AKFDUVKOLGRRIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-7-6-13-11(15-7)8-3-4-9(12)10(5-8)14-2/h3-6H,12H2,1-2H3.
What are the key properties of 2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline?
2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline has a molecular weight of 204.23 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-(5-methyl-1,3-oxazol-2-yl)aniline is sourced from PubChem (CID 82469941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).