1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine

C14H17FN4 — CID 82301704

IUPAC1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine
SMILESFc1ccccc1-c1ncc(CN2CCNCC2)[nH]1
InChIInChI=1S/C14H17FN4/c15-13-4-2-1-3-12(13)14-17-9-11(18-14)10-19-7-5-16-6-8-19/h1-4,9,16H,5-8,10H2,(H,17,18)
InChIKeyDOPCBHKHYUIXJS-UHFFFAOYSA-N
MW260.32 g/mol
LogP1.62
Rot. Bonds3

About 1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine

1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine (PubChem CID 82301704) has the molecular formula C14H17FN4 and a molecular weight of 260.32 g/mol. Its IUPAC name is 1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine.

Molecular Properties

Compound Name1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine
PubChem CID82301704
Molecular FormulaC14H17FN4
Molecular Weight260.32 g/mol
Exact Mass260.14
IUPAC Name1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine
SMILESFc1ccccc1-c1ncc(CN2CCNCC2)[nH]1
InChIInChI=1S/C14H17FN4/c15-13-4-2-1-3-12(13)14-17-9-11(18-14)10-19-7-5-16-6-8-19/h1-4,9,16H,5-8,10H2,(H,17,18)
InChIKeyDOPCBHKHYUIXJS-UHFFFAOYSA-N
XLogP1.62
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]-N-methyl-1-phenylmethanamine
CID 10379759
4-chloro-7-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]-5-methylpyrrolo[2,3-d]pyrimidine
CID 134535733
1-[(4-fluoro-3-phenylphenyl)methyl]piperazine
CID 117429281
4-fluoro-2-[4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazin-1-yl]pyrimidine
CID 10149949
1-[(2-fluorophenyl)methyl]-1,4-diazepane;hydrate;dihydrochloride
CID 47000648
1-[[2-(2-fluoro-5-methoxyphenyl)phenyl]methyl]piperazine
CID 56701153
1-[(2-phenyl-1H-imidazol-5-yl)methyl]-4-[(Z)-3-phenylprop-2-enyl]piperazine
CID 74226153
3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(2-piperazin-1-ylethyl)propanamide
CID 119446701
1-[(2,4-diphenyl-1H-imidazol-5-yl)methyl]piperazine
CID 123641592
piperazine;1-(pyridin-2-ylmethyl)piperazine
CID 174820345
N-[2-(2-fluorophenyl)ethyl]-2-piperazin-1-ylacetamide
CID 28505813
8-[2-[2-(piperazin-1-ylmethyl)phenyl]phenyl]quinoline
CID 91803359

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine?
The IUPAC name of 1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine (CID 82301704) is 1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine.
What is the SMILES notation for 1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine?
The canonical SMILES for 1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine is Fc1ccccc1-c1ncc(CN2CCNCC2)[nH]1.
What is the InChIKey of 1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine?
The InChIKey is DOPCBHKHYUIXJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4/c15-13-4-2-1-3-12(13)14-17-9-11(18-14)10-19-7-5-16-6-8-19/h1-4,9,16H,5-8,10H2,(H,17,18).
What are the key properties of 1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine?
1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine has a molecular weight of 260.32 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(2-fluorophenyl)-1H-imidazol-5-yl]methyl]piperazine is sourced from PubChem (CID 82301704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).