[5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine

C10H14N4O2 — CID 96606598

IUPAC[5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine
SMILESCOc1nc(CN)oc1-c1cnn(C)c1C
InChIInChI=1S/C10H14N4O2/c1-6-7(5-12-14(6)2)9-10(15-3)13-8(4-11)16-9/h5H,4,11H2,1-3H3
InChIKeyDWYQTFTWNLUPSF-UHFFFAOYSA-N
MW222.25 g/mol
LogP0.85
Rot. Bonds3

About [5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine

[5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine (PubChem CID 96606598) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is [5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine
PubChem CID96606598
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC Name[5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine
SMILESCOc1nc(CN)oc1-c1cnn(C)c1C
InChIInChI=1S/C10H14N4O2/c1-6-7(5-12-14(6)2)9-10(15-3)13-8(4-11)16-9/h5H,4,11H2,1-3H3
InChIKeyDWYQTFTWNLUPSF-UHFFFAOYSA-N
XLogP0.85
TPSA79.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine (CID 96606598) is [5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine is COc1nc(CN)oc1-c1cnn(C)c1C.
What is the InChIKey of [5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine?
The InChIKey is DWYQTFTWNLUPSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c1-6-7(5-12-14(6)2)9-10(15-3)13-8(4-11)16-9/h5H,4,11H2,1-3H3.
What are the key properties of [5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine?
[5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine has a molecular weight of 222.25 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1,5-dimethylpyrazol-4-yl)-4-methoxy-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 96606598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).