3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine

C14H15F2N3 — CID 43651028

IUPAC3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine
SMILESFc1ccc(F)c(-c2cnc(C3CCCNC3)[nH]2)c1
InChIInChI=1S/C14H15F2N3/c15-10-3-4-12(16)11(6-10)13-8-18-14(19-13)9-2-1-5-17-7-9/h3-4,6,8-9,17H,1-2,5,7H2,(H,18,19)
InChIKeyBTGSDTPAXFSCCJ-UHFFFAOYSA-N
MW263.29 g/mol
LogP2.82
Rot. Bonds2

About 3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine

3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine (PubChem CID 43651028) has the molecular formula C14H15F2N3 and a molecular weight of 263.29 g/mol. Its IUPAC name is 3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine.

Molecular Properties

Compound Name3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine
PubChem CID43651028
Molecular FormulaC14H15F2N3
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC Name3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine
SMILESFc1ccc(F)c(-c2cnc(C3CCCNC3)[nH]2)c1
InChIInChI=1S/C14H15F2N3/c15-10-3-4-12(16)11(6-10)13-8-18-14(19-13)9-2-1-5-17-7-9/h3-4,6,8-9,17H,1-2,5,7H2,(H,18,19)
InChIKeyBTGSDTPAXFSCCJ-UHFFFAOYSA-N
XLogP2.82
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine 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-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine?
The IUPAC name of 3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine (CID 43651028) is 3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine.
What is the SMILES notation for 3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine?
The canonical SMILES for 3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine is Fc1ccc(F)c(-c2cnc(C3CCCNC3)[nH]2)c1.
What is the InChIKey of 3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine?
The InChIKey is BTGSDTPAXFSCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3/c15-10-3-4-12(16)11(6-10)13-8-18-14(19-13)9-2-1-5-17-7-9/h3-4,6,8-9,17H,1-2,5,7H2,(H,18,19).
What are the key properties of 3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine?
3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine has a molecular weight of 263.29 g/mol, XLogP of 2.82, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(2,5-difluorophenyl)-1H-imidazol-2-yl]piperidine is sourced from PubChem (CID 43651028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).