1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine

C15H20F2N4 — CID 10756202

IUPAC1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine
SMILESCN1CCN(Cc2ccc(F)cc2F)C(C2=NCCN2)C1
InChIInChI=1S/C15H20F2N4/c1-20-6-7-21(14(10-20)15-18-4-5-19-15)9-11-2-3-12(16)8-13(11)17/h2-3,8,14H,4-7,9-10H2,1H3,(H,18,19)
InChIKeyULQIBMRCWIVLAD-UHFFFAOYSA-N
MW294.35 g/mol
LogP1.08
Rot. Bonds3

About 1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine

1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine (PubChem CID 10756202) has the molecular formula C15H20F2N4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine.

Molecular Properties

Compound Name1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine
PubChem CID10756202
Molecular FormulaC15H20F2N4
Molecular Weight294.35 g/mol
Exact Mass294.17
IUPAC Name1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine
SMILESCN1CCN(Cc2ccc(F)cc2F)C(C2=NCCN2)C1
InChIInChI=1S/C15H20F2N4/c1-20-6-7-21(14(10-20)15-18-4-5-19-15)9-11-2-3-12(16)8-13(11)17/h2-3,8,14H,4-7,9-10H2,1H3,(H,18,19)
InChIKeyULQIBMRCWIVLAD-UHFFFAOYSA-N
XLogP1.08
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine 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-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine?
The IUPAC name of 1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine (CID 10756202) is 1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine.
What is the SMILES notation for 1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine?
The canonical SMILES for 1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine is CN1CCN(Cc2ccc(F)cc2F)C(C2=NCCN2)C1.
What is the InChIKey of 1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine?
The InChIKey is ULQIBMRCWIVLAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N4/c1-20-6-7-21(14(10-20)15-18-4-5-19-15)9-11-2-3-12(16)8-13(11)17/h2-3,8,14H,4-7,9-10H2,1H3,(H,18,19).
What are the key properties of 1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine?
1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine has a molecular weight of 294.35 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,4-difluorophenyl)methyl]-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine is sourced from PubChem (CID 10756202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).