4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide

C15H15F2N5O2 — CID 142622781

IUPAC4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide
SMILESO=C(Nc1ccc(O)cn1)N1CCN(c2ncc(F)cc2F)CC1
InChIInChI=1S/C15H15F2N5O2/c16-10-7-12(17)14(19-8-10)21-3-5-22(6-4-21)15(24)20-13-2-1-11(23)9-18-13/h1-2,7-9,23H,3-6H2,(H,18,20,24)
InChIKeyVTHNZSUGIOTUSH-UHFFFAOYSA-N
MW335.31 g/mol
LogP1.81
Rot. Bonds2

About 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide

4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide (PubChem CID 142622781) has the molecular formula C15H15F2N5O2 and a molecular weight of 335.31 g/mol. Its IUPAC name is 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide
PubChem CID142622781
Molecular FormulaC15H15F2N5O2
Molecular Weight335.31 g/mol
Exact Mass335.12
IUPAC Name4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide
SMILESO=C(Nc1ccc(O)cn1)N1CCN(c2ncc(F)cc2F)CC1
InChIInChI=1S/C15H15F2N5O2/c16-10-7-12(17)14(19-8-10)21-3-5-22(6-4-21)15(24)20-13-2-1-11(23)9-18-13/h1-2,7-9,23H,3-6H2,(H,18,20,24)
InChIKeyVTHNZSUGIOTUSH-UHFFFAOYSA-N
XLogP1.81
TPSA81.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.31
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide 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 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide?
The IUPAC name of 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide (CID 142622781) is 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide is O=C(Nc1ccc(O)cn1)N1CCN(c2ncc(F)cc2F)CC1.
What is the InChIKey of 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide?
The InChIKey is VTHNZSUGIOTUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2N5O2/c16-10-7-12(17)14(19-8-10)21-3-5-22(6-4-21)15(24)20-13-2-1-11(23)9-18-13/h1-2,7-9,23H,3-6H2,(H,18,20,24).
What are the key properties of 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide?
4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide has a molecular weight of 335.31 g/mol, XLogP of 1.81, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-difluoro-2-pyridinyl)-N-(5-hydroxy-2-pyridinyl)piperazine-1-carboxamide is sourced from PubChem (CID 142622781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).