1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine

C11H19N3O — CID 115082202

IUPAC1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine
SMILESCC(N)c1coc(C2CCN(C)CC2)n1
InChIInChI=1S/C11H19N3O/c1-8(12)10-7-15-11(13-10)9-3-5-14(2)6-4-9/h7-9H,3-6,12H2,1-2H3
InChIKeyBLCISZWLWLIBQF-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.50
Rot. Bonds2

About 1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine

1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine (PubChem CID 115082202) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine.

Molecular Properties

Compound Name1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine
PubChem CID115082202
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine
SMILESCC(N)c1coc(C2CCN(C)CC2)n1
InChIInChI=1S/C11H19N3O/c1-8(12)10-7-15-11(13-10)9-3-5-14(2)6-4-9/h7-9H,3-6,12H2,1-2H3
InChIKeyBLCISZWLWLIBQF-UHFFFAOYSA-N
XLogP1.50
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(1-methylpyrrolidin-3-yl)-1,3-oxazol-4-yl]ethanol
CID 115081999
4-methyl-2-(1-methylpiperidin-4-yl)-1,3-oxazole
CID 130653621
1-[2-(thian-2-yl)-1,3-oxazol-4-yl]ethanamine
CID 115082953
2-[2-(1-ethylpiperidin-4-yl)-1,3-oxazol-4-yl]propan-1-amine
CID 115082192
1-[2-(1-ethylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanol
CID 115082141
1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-5-yl]propan-2-amine
CID 115085155
2-(2-cyclohexyl-1,3-oxazol-4-yl)propan-1-ol
CID 115084637
[2-(1-methylpyrrolidin-3-yl)-1,3-oxazol-4-yl]methanamine
CID 115082061
2-[2-(1-methylpiperidin-3-yl)-1,3-oxazol-4-yl]propan-1-ol
CID 115082650
2-[2-(oxan-4-yl)-1,3-oxazol-4-yl]propan-1-amine
CID 115082182
1-[2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1,3-oxazol-4-yl]ethanamine
CID 115083115
1-[2-(1-ethylpyrrolidin-3-yl)-1,3-oxazol-4-yl]-N-methylethanamine
CID 115082080

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine?
The IUPAC name of 1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine (CID 115082202) is 1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine.
What is the SMILES notation for 1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine?
The canonical SMILES for 1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine is CC(N)c1coc(C2CCN(C)CC2)n1.
What is the InChIKey of 1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine?
The InChIKey is BLCISZWLWLIBQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-8(12)10-7-15-11(13-10)9-3-5-14(2)6-4-9/h7-9H,3-6,12H2,1-2H3.
What are the key properties of 1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine?
1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine has a molecular weight of 209.29 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-methylpiperidin-4-yl)-1,3-oxazol-4-yl]ethanamine is sourced from PubChem (CID 115082202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).