5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine

C10H9ClN2O2 — CID 82287443

IUPAC5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine
SMILESCOc1ccc(-c2cnc(N)o2)c(Cl)c1
InChIInChI=1S/C10H9ClN2O2/c1-14-6-2-3-7(8(11)4-6)9-5-13-10(12)15-9/h2-5H,1H3,(H2,12,13)
InChIKeyFEKYSLXPXXPURZ-UHFFFAOYSA-N
MW224.65 g/mol
LogP2.59
Rot. Bonds2

About 5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine

5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine (PubChem CID 82287443) has the molecular formula C10H9ClN2O2 and a molecular weight of 224.65 g/mol. Its IUPAC name is 5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine.

Molecular Properties

Compound Name5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine
PubChem CID82287443
Molecular FormulaC10H9ClN2O2
Molecular Weight224.65 g/mol
Exact Mass224.04
IUPAC Name5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine
SMILESCOc1ccc(-c2cnc(N)o2)c(Cl)c1
InChIInChI=1S/C10H9ClN2O2/c1-14-6-2-3-7(8(11)4-6)9-5-13-10(12)15-9/h2-5H,1H3,(H2,12,13)
InChIKeyFEKYSLXPXXPURZ-UHFFFAOYSA-N
XLogP2.59
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.65
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(4-methoxy-2-methylphenyl)-1,3-oxazol-2-yl]methanamine
CID 82360064
2-[5-(2-fluoro-4-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 102885541
5-(2,5-dimethoxy-4-methylphenyl)-1,3-oxazol-2-amine
CID 82290583
2-(chloromethyl)-5-(2,5-dimethoxyphenyl)-1,3-oxazole
CID 43144202
2-chloro-5-(2-chloro-4-methoxyphenyl)-4-methylpyrimidine
CID 170925653
1,3,5-trichloro-2-(2-chloro-4-methoxyphenyl)benzene
CID 134628384
3-[5-(2-fluoro-4-methoxyphenyl)-1,3-oxazol-2-yl]propan-1-amine
CID 102885542
[5-(2-bromo-5-methoxyphenyl)-1,3-oxazol-2-yl]methanamine
CID 65179787
[5-(2-chloro-4-methoxyphenyl)-1H-imidazol-2-yl]hydrazine
CID 116884142
5-(2,3,4-trimethylphenyl)-1,3-oxazol-2-amine
CID 116832317
2-bromo-5-(2-chloro-4-methoxyphenyl)-1H-imidazole
CID 116884290
2-(1-chloroethyl)-5-(2-fluoro-4-methoxyphenyl)-1,3-oxazole
CID 102885537

Frequently Asked Questions

What is the IUPAC name of 5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine?
The IUPAC name of 5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine (CID 82287443) is 5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine.
What is the SMILES notation for 5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine?
The canonical SMILES for 5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine is COc1ccc(-c2cnc(N)o2)c(Cl)c1.
What is the InChIKey of 5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine?
The InChIKey is FEKYSLXPXXPURZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O2/c1-14-6-2-3-7(8(11)4-6)9-5-13-10(12)15-9/h2-5H,1H3,(H2,12,13).
What are the key properties of 5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine?
5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine has a molecular weight of 224.65 g/mol, XLogP of 2.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chloro-4-methoxyphenyl)-1,3-oxazol-2-amine is sourced from PubChem (CID 82287443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).