3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine

C9H15N3O — CID 115015914

IUPAC3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine
SMILESCN1CCCCC1c1cc(N)on1
InChIInChI=1S/C9H15N3O/c1-12-5-3-2-4-8(12)7-6-9(10)13-11-7/h6,8H,2-5,10H2,1H3
InChIKeyGQDWFOJTWIGNLL-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.41
Rot. Bonds1

About 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine

3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine (PubChem CID 115015914) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine
PubChem CID115015914
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine
SMILESCN1CCCCC1c1cc(N)on1
InChIInChI=1S/C9H15N3O/c1-12-5-3-2-4-8(12)7-6-9(10)13-11-7/h6,8H,2-5,10H2,1H3
InChIKeyGQDWFOJTWIGNLL-UHFFFAOYSA-N
XLogP1.41
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine?
The IUPAC name of 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine (CID 115015914) is 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine is CN1CCCCC1c1cc(N)on1.
What is the InChIKey of 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine?
The InChIKey is GQDWFOJTWIGNLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-12-5-3-2-4-8(12)7-6-9(10)13-11-7/h6,8H,2-5,10H2,1H3.
What are the key properties of 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine?
3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine has a molecular weight of 181.24 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpiperidin-2-yl)-1,2-oxazol-5-amine is sourced from PubChem (CID 115015914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).