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

C10H10N2O2 — CID 82468773

IUPAC2-methoxy-4-(1,3-oxazol-2-yl)aniline
SMILESCOc1cc(-c2ncco2)ccc1N
InChIInChI=1S/C10H10N2O2/c1-13-9-6-7(2-3-8(9)11)10-12-4-5-14-10/h2-6H,11H2,1H3
InChIKeyYBGCHGLEETUPPO-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.93
Rot. Bonds2

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

2-methoxy-4-(1,3-oxazol-2-yl)aniline (PubChem CID 82468773) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 2-methoxy-4-(1,3-oxazol-2-yl)aniline.

Molecular Properties

Compound Name2-methoxy-4-(1,3-oxazol-2-yl)aniline
PubChem CID82468773
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name2-methoxy-4-(1,3-oxazol-2-yl)aniline
SMILESCOc1cc(-c2ncco2)ccc1N
InChIInChI=1S/C10H10N2O2/c1-13-9-6-7(2-3-8(9)11)10-12-4-5-14-10/h2-6H,11H2,1H3
InChIKeyYBGCHGLEETUPPO-UHFFFAOYSA-N
XLogP1.93
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.93
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-(5-methyl-1,3-oxazol-2-yl)aniline
CID 82469941
4-methoxy-6-(1,3-oxazol-2-yl)-1,2-benzoxazol-3-amine
CID 146278275
4-(4-amino-3-methoxyphenyl)-2-methoxyaniline;benzene
CID 157477717
2-(4-amino-3-methoxyphenyl)-1H-pyrimidin-6-one
CID 82471766
4-(4-tert-butylpyrimidin-2-yl)-2-methoxyaniline
CID 82483089
2-methoxy-4-(5-propyl-1,3,4-oxadiazol-2-yl)aniline
CID 104783442
4-(4-amino-3-methoxyphenyl)-2-methoxyaniline;5H-tetrazole
CID 175609219
N-[(2-chlorophenyl)methyl]-2-[2-methoxy-4-(1,3-oxazol-2-yl)phenyl]ethanamine
CID 168972875
2-amino-5-(4-amino-3-methoxyphenyl)phenol
CID 131862396
4-(5-tert-butyl-1H-imidazol-2-yl)-2-methoxyaniline
CID 113452714
2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole
CID 123773885
5-[4-(1,3-oxazol-2-yl)phenyl]-1,2-oxazol-3-amine
CID 117326354

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-(1,3-oxazol-2-yl)aniline?
The IUPAC name of 2-methoxy-4-(1,3-oxazol-2-yl)aniline (CID 82468773) is 2-methoxy-4-(1,3-oxazol-2-yl)aniline.
What is the SMILES notation for 2-methoxy-4-(1,3-oxazol-2-yl)aniline?
The canonical SMILES for 2-methoxy-4-(1,3-oxazol-2-yl)aniline is COc1cc(-c2ncco2)ccc1N.
What is the InChIKey of 2-methoxy-4-(1,3-oxazol-2-yl)aniline?
The InChIKey is YBGCHGLEETUPPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-13-9-6-7(2-3-8(9)11)10-12-4-5-14-10/h2-6H,11H2,1H3.
What are the key properties of 2-methoxy-4-(1,3-oxazol-2-yl)aniline?
2-methoxy-4-(1,3-oxazol-2-yl)aniline has a molecular weight of 190.20 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-(1,3-oxazol-2-yl)aniline is sourced from PubChem (CID 82468773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).