3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine

C12H15N3O — CID 117309650

IUPAC3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine
SMILESCc1ccc(N(C)C)c(-c2cc(N)on2)c1
InChIInChI=1S/C12H15N3O/c1-8-4-5-11(15(2)3)9(6-8)10-7-12(13)16-14-10/h4-7H,13H2,1-3H3
InChIKeyUESDPNZNVYPYEY-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.30
Rot. Bonds2

About 3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine

3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine (PubChem CID 117309650) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine
PubChem CID117309650
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine
SMILESCc1ccc(N(C)C)c(-c2cc(N)on2)c1
InChIInChI=1S/C12H15N3O/c1-8-4-5-11(15(2)3)9(6-8)10-7-12(13)16-14-10/h4-7H,13H2,1-3H3
InChIKeyUESDPNZNVYPYEY-UHFFFAOYSA-N
XLogP2.30
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-ethyl-5-methylphenyl)-1,2-oxazol-5-amine
CID 117290975
N,N,4-trimethyl-2-(1,2-oxazol-3-yl)aniline
CID 174436270
3-[3-(dimethylamino)-4-methylphenyl]-1,2-oxazol-5-amine
CID 115112364
2-(5-amino-1,2-oxazol-3-yl)-6-fluoro-4-methylphenol
CID 136998714
3-(2-fluoro-3,5-dimethylphenyl)-1,2-oxazol-5-amine
CID 117294555
2-(5-amino-1,2-oxazol-3-yl)-5-methylbenzene-1,4-diol
CID 136998676
3-(3-chloro-2-fluoro-5-methylphenyl)-1,2-oxazol-5-amine
CID 117325884
3-(4-tert-butyl-2-methylphenyl)-1,2-oxazol-5-amine
CID 82474477
4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol
CID 137012596
3-(2-bromo-3-methoxy-5-methylphenyl)-1,2-oxazol-5-amine
CID 117454853
3-N,3-N-dimethyl-1,2-oxazole-3,5-diamine
CID 83863959
3-(2-chloro-3-fluoro-4-methylphenyl)-1,2-oxazol-5-amine
CID 117325881

Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine?
The IUPAC name of 3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine (CID 117309650) is 3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine.
What is the SMILES notation for 3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine?
The canonical SMILES for 3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine is Cc1ccc(N(C)C)c(-c2cc(N)on2)c1.
What is the InChIKey of 3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine?
The InChIKey is UESDPNZNVYPYEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-8-4-5-11(15(2)3)9(6-8)10-7-12(13)16-14-10/h4-7H,13H2,1-3H3.
What are the key properties of 3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine?
3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine has a molecular weight of 217.27 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)-5-methylphenyl]-1,2-oxazol-5-amine is sourced from PubChem (CID 117309650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).