3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

C15H16N4O2 — CID 52998644

IUPAC3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
SMILESCCc1noc2ncnc(Nc3cc(C)ccc3OC)c12
InChIInChI=1S/C15H16N4O2/c1-4-10-13-14(16-8-17-15(13)21-19-10)18-11-7-9(2)5-6-12(11)20-3/h5-8H,4H2,1-3H3,(H,16,17,18)
InChIKeyKBGTXVJYDNCXPB-UHFFFAOYSA-N
MW284.32 g/mol
LogP3.24
Rot. Bonds4

About 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine (PubChem CID 52998644) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
PubChem CID52998644
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
SMILESCCc1noc2ncnc(Nc3cc(C)ccc3OC)c12
InChIInChI=1S/C15H16N4O2/c1-4-10-13-14(16-8-17-15(13)21-19-10)18-11-7-9(2)5-6-12(11)20-3/h5-8H,4H2,1-3H3,(H,16,17,18)
InChIKeyKBGTXVJYDNCXPB-UHFFFAOYSA-N
XLogP3.24
TPSA73.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-N-(2-methoxy-5-methylphenyl)-5-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80736748
N-(2,4-dimethoxyphenyl)-3-ethyl-6-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
CID 52998677
ethyl 4-[(3-ethyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]benzoate
CID 52998633
6-N-(2,3-dimethylphenyl)-4-N-(2-methoxy-5-methylphenyl)pyrimidine-4,5,6-triamine
CID 22541866
6-chloro-2-ethyl-N-(2-methoxy-5-methylphenyl)-5-methylpyrimidin-4-amine
CID 80974359
6-(4-ethylphenoxy)-4-N-(2-methoxy-5-methylphenyl)pyrimidine-4,5-diamine
CID 22541998
6-N-(2-methoxy-5-methylphenyl)-4-N-(1-methoxypropan-2-yl)pyrimidine-4,5,6-triamine
CID 22541991
4-chloro-6-(2-methoxy-5-methylanilino)pyrimidine-5-carbaldehyde
CID 66366723
4-N-(2,5-dimethoxyphenyl)-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80769342
2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine
CID 81131819
6-chloro-N-(2,5-dimethoxyphenyl)-5-ethylpyrimidin-4-amine
CID 63734399
6-N-(2,4-dichlorophenyl)-4-N-(2-methoxy-5-methylphenyl)pyrimidine-4,5,6-triamine
CID 22541920

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine (CID 52998644) is 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine is CCc1noc2ncnc(Nc3cc(C)ccc3OC)c12.
What is the InChIKey of 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is KBGTXVJYDNCXPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-4-10-13-14(16-8-17-15(13)21-19-10)18-11-7-9(2)5-6-12(11)20-3/h5-8H,4H2,1-3H3,(H,16,17,18).
What are the key properties of 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine?
3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 284.32 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(2-methoxy-5-methylphenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 52998644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).