1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid

C10H16F3N3O3 — CID 143265147

IUPAC1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid
SMILESO=C(O)C(F)(F)F.O=C1NCCN1C1CCNCC1
InChIInChI=1S/C8H15N3O.C2HF3O2/c12-8-10-5-6-11(8)7-1-3-9-4-2-7;3-2(4,5)1(6)7/h7,9H,1-6H2,(H,10,12);(H,6,7)
InChIKeyBPNGYSDMMXTJRE-UHFFFAOYSA-N
MW283.25 g/mol
LogP0.40
Rot. Bonds1

About 1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid

1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid (PubChem CID 143265147) has the molecular formula C10H16F3N3O3 and a molecular weight of 283.25 g/mol. Its IUPAC name is 1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound Name1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid
PubChem CID143265147
Molecular FormulaC10H16F3N3O3
Molecular Weight283.25 g/mol
Exact Mass283.11
IUPAC Name1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid
SMILESO=C(O)C(F)(F)F.O=C1NCCN1C1CCNCC1
InChIInChI=1S/C8H15N3O.C2HF3O2/c12-8-10-5-6-11(8)7-1-3-9-4-2-7;3-2(4,5)1(6)7/h7,9H,1-6H2,(H,10,12);(H,6,7)
InChIKeyBPNGYSDMMXTJRE-UHFFFAOYSA-N
XLogP0.40
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.25
LogP ≤ 50.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid 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-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid?
The IUPAC name of 1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid (CID 143265147) is 1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid.
What is the SMILES notation for 1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid?
The canonical SMILES for 1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid is O=C(O)C(F)(F)F.O=C1NCCN1C1CCNCC1.
What is the InChIKey of 1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid?
The InChIKey is BPNGYSDMMXTJRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O.C2HF3O2/c12-8-10-5-6-11(8)7-1-3-9-4-2-7;3-2(4,5)1(6)7/h7,9H,1-6H2,(H,10,12);(H,6,7).
What are the key properties of 1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid?
1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid has a molecular weight of 283.25 g/mol, XLogP of 0.40, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 143265147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).