[2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine

C10H14N4O2 — CID 116803107

IUPAC[2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine
SMILESCC(C)n1cc(Oc2nc(CN)co2)cn1
InChIInChI=1S/C10H14N4O2/c1-7(2)14-5-9(4-12-14)16-10-13-8(3-11)6-15-10/h4-7H,3,11H2,1-2H3
InChIKeyBYMWAFKMYLQBBF-UHFFFAOYSA-N
MW222.25 g/mol
LogP1.70
Rot. Bonds4

About [2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine

[2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine (PubChem CID 116803107) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is [2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine.

Molecular Properties

Compound Name[2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine
PubChem CID116803107
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC Name[2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine
SMILESCC(C)n1cc(Oc2nc(CN)co2)cn1
InChIInChI=1S/C10H14N4O2/c1-7(2)14-5-9(4-12-14)16-10-13-8(3-11)6-15-10/h4-7H,3,11H2,1-2H3
InChIKeyBYMWAFKMYLQBBF-UHFFFAOYSA-N
XLogP1.70
TPSA79.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazole-4-carboxylic acid
CID 116800857
[2-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-5-yl]methanamine
CID 116802334
[2-(1-propan-2-ylpyrazol-4-yl)oxyquinolin-4-yl]methanamine
CID 116800179
[3-bromo-4-(1-propan-2-ylpyrazol-4-yl)oxyphenyl]methanamine
CID 116800206
3-(1-propan-2-ylpyrazol-4-yl)oxypropan-1-amine
CID 116800727
[5-chloro-6-(1-propan-2-ylpyrazol-4-yl)oxy-3-pyridinyl]methanamine
CID 116803066
[5-chloro-2-(1-propan-2-ylpyrazol-4-yl)oxy-4-pyridinyl]methanamine
CID 114929125
2,4-dichloro-6-(1-propan-2-ylpyrazol-4-yl)oxy-1,3,5-triazine
CID 116801169
2-[3,5-difluoro-4-(1-propan-2-ylpyrazol-4-yl)oxyphenyl]ethanamine
CID 116804257
[5-bromo-4-(1-propan-2-ylpyrazol-4-yl)oxypyrimidin-2-yl]hydrazine
CID 116806928
3-(1-propan-2-ylpyrazol-4-yl)oxypyrazin-2-amine
CID 102988441
2-[3-fluoro-5-(1-propan-2-ylpyrazol-4-yl)oxyphenyl]ethanamine
CID 106533565

Frequently Asked Questions

What is the IUPAC name of [2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine?
The IUPAC name of [2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine (CID 116803107) is [2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine.
What is the SMILES notation for [2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine?
The canonical SMILES for [2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine is CC(C)n1cc(Oc2nc(CN)co2)cn1.
What is the InChIKey of [2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine?
The InChIKey is BYMWAFKMYLQBBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c1-7(2)14-5-9(4-12-14)16-10-13-8(3-11)6-15-10/h4-7H,3,11H2,1-2H3.
What are the key properties of [2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine?
[2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine has a molecular weight of 222.25 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-oxazol-4-yl]methanamine is sourced from PubChem (CID 116803107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).