tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate

C18H24FN3O2 — CID 76562719

IUPACtert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCCCC1Cc1cn2cccc(F)c2n1
InChIInChI=1S/C18H24FN3O2/c1-18(2,3)24-17(23)22-10-5-4-7-14(22)11-13-12-21-9-6-8-15(19)16(21)20-13/h6,8-9,12,14H,4-5,7,10-11H2,1-3H3
InChIKeyWTBIBIJFMBUHGC-UHFFFAOYSA-N
MW333.41 g/mol
LogP3.81
Rot. Bonds2

About tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate

tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate (PubChem CID 76562719) has the molecular formula C18H24FN3O2 and a molecular weight of 333.41 g/mol. Its IUPAC name is tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate
PubChem CID76562719
Molecular FormulaC18H24FN3O2
Molecular Weight333.41 g/mol
Exact Mass333.19
IUPAC Nametert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCCCC1Cc1cn2cccc(F)c2n1
InChIInChI=1S/C18H24FN3O2/c1-18(2,3)24-17(23)22-10-5-4-7-14(22)11-13-12-21-9-6-8-15(19)16(21)20-13/h6,8-9,12,14H,4-5,7,10-11H2,1-3H3
InChIKeyWTBIBIJFMBUHGC-UHFFFAOYSA-N
XLogP3.81
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Imidazopyridine 18a
CID 5329351
Imidazopyridine 18d
CID 5329354
2-(8-Fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-7-(4-methylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-4-one
CID 89740936
Piperazine carbamate/urea derivative 4
CID 89487751
{4-[7-Dimethylaminomethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl}carbamic acid methyl ester
CID 44444872
4-[5-(2-Amino-pyrimidin-4-yl)-4-(4-fluoro-phenyl)-imidazol-1-yl]-piperidine-1-carboxylic acid ethyl ester
CID 15407403
N-[2-(3-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]piperidine-1-carboxamide
CID 130247052
N-[2-(2,3-difluorophenyl)imidazo[1,2-a]pyridin-7-yl]piperidine-1-carboxamide
CID 130247070
(2R)-4-(3-fluoro-4-pyridinyl)-N-[(1R)-1-imidazo[1,2-a]pyridin-5-ylethyl]-2-methylpiperazine-1-carboxamide
CID 155749606
(1-Imidazo[1,2-a]pyridin-7-ylpiperidin-4-yl) 4-cyclobutylpiperazine-1-carboxylate
CID 89487702
4-Imidazo[1,2-a]pyridin-2-ylmethyl-piperazine-1-carboxylic acid ethyl ester
CID 651683
2-{[4-(4-Fluorophenyl)-1-piperazinyl]methyl}imidazo[1,2-a]pyridine
CID 1248739

Frequently Asked Questions

What is the IUPAC name of tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate?
The IUPAC name of tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate (CID 76562719) is tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate?
The canonical SMILES for tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate is CC(C)(C)OC(=O)N1CCCCC1Cc1cn2cccc(F)c2n1.
What is the InChIKey of tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate?
The InChIKey is WTBIBIJFMBUHGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FN3O2/c1-18(2,3)24-17(23)22-10-5-4-7-14(22)11-13-12-21-9-6-8-15(19)16(21)20-13/h6,8-9,12,14H,4-5,7,10-11H2,1-3H3.
What are the key properties of tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate?
tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate has a molecular weight of 333.41 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 2-[(8-fluoroimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-1-carboxylate is sourced from PubChem (CID 76562719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).