3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine

C18H19FN4 — CID 117236217

IUPAC3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine
SMILESFc1ccccc1Cc1ncc2cc(N3CCNCC3)ccn12
InChIInChI=1S/C18H19FN4/c19-17-4-2-1-3-14(17)11-18-21-13-16-12-15(5-8-23(16)18)22-9-6-20-7-10-22/h1-5,8,12-13,20H,6-7,9-11H2
InChIKeyDSBUKDPZOFSCAL-UHFFFAOYSA-N
MW310.38 g/mol
LogP2.47
Rot. Bonds3

About 3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine

3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine (PubChem CID 117236217) has the molecular formula C18H19FN4 and a molecular weight of 310.38 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine
PubChem CID117236217
Molecular FormulaC18H19FN4
Molecular Weight310.38 g/mol
Exact Mass310.16
IUPAC Name3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine
SMILESFc1ccccc1Cc1ncc2cc(N3CCNCC3)ccn12
InChIInChI=1S/C18H19FN4/c19-17-4-2-1-3-14(17)11-18-21-13-16-12-15(5-8-23(16)18)22-9-6-20-7-10-22/h1-5,8,12-13,20H,6-7,9-11H2
InChIKeyDSBUKDPZOFSCAL-UHFFFAOYSA-N
XLogP2.47
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-7-piperazin-1-ylimidazo[1,5-a]pyridine
CID 83894528
7-bromo-3-[(2-fluorophenyl)methyl]imidazo[1,5-a]pyridine
CID 117144523
2-(7-piperazin-1-ylimidazo[1,5-a]pyridin-3-yl)ethanol
CID 117236108
7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine
CID 117236205
3-(5-methylthiophen-2-yl)-7-piperazin-1-ylimidazo[1,5-a]pyridine
CID 117236195
7-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine
CID 117144494
N-[(2-fluorophenyl)methyl]-3-(6-oxo-4-piperazin-1-ylpyridazin-1-yl)propanamide;hydrochloride
CID 154892763
3-[(2-chlorophenyl)methyl]imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117145233
3-[(2-fluorophenyl)methyl]imidazo[1,5-a]pyridine-8-carbaldehyde
CID 117146101
1-(3,4-difluorophenyl)piperazine
CID 2783122
3-[(2-bromophenyl)methyl]-7-methoxyimidazo[1,5-a]pyridine
CID 117143084
2-(imidazo[1,5-a]pyridin-3-ylmethyl)phenol
CID 117139622

Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine?
The IUPAC name of 3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine (CID 117236217) is 3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine.
What is the SMILES notation for 3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine?
The canonical SMILES for 3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine is Fc1ccccc1Cc1ncc2cc(N3CCNCC3)ccn12.
What is the InChIKey of 3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine?
The InChIKey is DSBUKDPZOFSCAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN4/c19-17-4-2-1-3-14(17)11-18-21-13-16-12-15(5-8-23(16)18)22-9-6-20-7-10-22/h1-5,8,12-13,20H,6-7,9-11H2.
What are the key properties of 3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine?
3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine has a molecular weight of 310.38 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)methyl]-7-piperazin-1-ylimidazo[1,5-a]pyridine is sourced from PubChem (CID 117236217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).