N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine

C13H16BrN3 — CID 102871570

IUPACN-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine
SMILESBrCCN(c1cccc2nccn12)C1CCC1
InChIInChI=1S/C13H16BrN3/c14-7-9-16(11-3-1-4-11)13-6-2-5-12-15-8-10-17(12)13/h2,5-6,8,10-11H,1,3-4,7,9H2
InChIKeyFPYAWMLGWDOCTJ-UHFFFAOYSA-N
MW294.20 g/mol
LogP3.09
Rot. Bonds4

About N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine

N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine (PubChem CID 102871570) has the molecular formula C13H16BrN3 and a molecular weight of 294.20 g/mol. Its IUPAC name is N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine.

Molecular Properties

Compound NameN-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine
PubChem CID102871570
Molecular FormulaC13H16BrN3
Molecular Weight294.20 g/mol
Exact Mass293.05
IUPAC NameN-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine
SMILESBrCCN(c1cccc2nccn12)C1CCC1
InChIInChI=1S/C13H16BrN3/c14-7-9-16(11-3-1-4-11)13-6-2-5-12-15-8-10-17(12)13/h2,5-6,8,10-11H,1,3-4,7,9H2
InChIKeyFPYAWMLGWDOCTJ-UHFFFAOYSA-N
XLogP3.09
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.20
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-(2-bromoethyl)-N-cyclopentylpyridin-2-amine
CID 80669086
N,N-dimethylimidazo[1,2-a]pyridin-5-amine
CID 130557663
N-(2-bromoethyl)-N-cyclopropyl-3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 80667013
N-(3-bromopropyl)-N-cyclobutylpyrazolo[1,5-a]pyrazin-4-amine
CID 102871209
1-[[imidazo[1,2-a]pyridin-5-yl(methyl)amino]methyl]cyclopentan-1-ol
CID 102626671
5-[2-(bromomethyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine
CID 102627084
N-(2-bromoethyl)-N-cyclobutyl-6-methoxypyridin-2-amine
CID 102871547
N-(2-bromoethyl)-N-cyclopentyl-3-methylpyridin-2-amine
CID 80668380
N-(2-bromoethyl)-N-cyclopentyl-3-fluoropyridin-2-amine
CID 80669537
N-(2-bromoethyl)-N-cyclopropylpyridin-4-amine
CID 80667987
5-(bromomethyl)imidazo[1,2-a]pyridine;hydrobromide
CID 121232171
N-(2-bromoethyl)-N-cyclobutyl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 102871523

Frequently Asked Questions

What is the IUPAC name of N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine?
The IUPAC name of N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine (CID 102871570) is N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine.
What is the SMILES notation for N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine?
The canonical SMILES for N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine is BrCCN(c1cccc2nccn12)C1CCC1.
What is the InChIKey of N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine?
The InChIKey is FPYAWMLGWDOCTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16BrN3/c14-7-9-16(11-3-1-4-11)13-6-2-5-12-15-8-10-17(12)13/h2,5-6,8,10-11H,1,3-4,7,9H2.
What are the key properties of N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine?
N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine has a molecular weight of 294.20 g/mol, XLogP of 3.09, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromoethyl)-N-cyclobutylimidazo[1,2-a]pyridin-5-amine is sourced from PubChem (CID 102871570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).