1-(oxetan-3-yl)-4-propan-2-ylpiperazine

C10H20N2O — CID 58450896

IUPAC1-(oxetan-3-yl)-4-propan-2-ylpiperazine
SMILESCC(C)N1CCN(C2COC2)CC1
InChIInChI=1S/C10H20N2O/c1-9(2)11-3-5-12(6-4-11)10-7-13-8-10/h9-10H,3-8H2,1-2H3
InChIKeyPRSNRWOZXNPGEC-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.41
Rot. Bonds2

About 1-(oxetan-3-yl)-4-propan-2-ylpiperazine

1-(oxetan-3-yl)-4-propan-2-ylpiperazine (PubChem CID 58450896) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-(oxetan-3-yl)-4-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-(oxetan-3-yl)-4-propan-2-ylpiperazine
PubChem CID58450896
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-(oxetan-3-yl)-4-propan-2-ylpiperazine
SMILESCC(C)N1CCN(C2COC2)CC1
InChIInChI=1S/C10H20N2O/c1-9(2)11-3-5-12(6-4-11)10-7-13-8-10/h9-10H,3-8H2,1-2H3
InChIKeyPRSNRWOZXNPGEC-UHFFFAOYSA-N
XLogP0.41
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(oxetan-3-yl)-4-propan-2-ylpiperazine 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 1-(oxetan-3-yl)-4-propan-2-ylpiperazine?
The IUPAC name of 1-(oxetan-3-yl)-4-propan-2-ylpiperazine (CID 58450896) is 1-(oxetan-3-yl)-4-propan-2-ylpiperazine.
What is the SMILES notation for 1-(oxetan-3-yl)-4-propan-2-ylpiperazine?
The canonical SMILES for 1-(oxetan-3-yl)-4-propan-2-ylpiperazine is CC(C)N1CCN(C2COC2)CC1.
What is the InChIKey of 1-(oxetan-3-yl)-4-propan-2-ylpiperazine?
The InChIKey is PRSNRWOZXNPGEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-9(2)11-3-5-12(6-4-11)10-7-13-8-10/h9-10H,3-8H2,1-2H3.
What are the key properties of 1-(oxetan-3-yl)-4-propan-2-ylpiperazine?
1-(oxetan-3-yl)-4-propan-2-ylpiperazine has a molecular weight of 184.28 g/mol, XLogP of 0.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxetan-3-yl)-4-propan-2-ylpiperazine is sourced from PubChem (CID 58450896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).