3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine

C10H12ClN3 — CID 43478139

IUPAC3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine
SMILESCN(C)c1nc2ccccn2c1CCl
InChIInChI=1S/C10H12ClN3/c1-13(2)10-8(7-11)14-6-4-3-5-9(14)12-10/h3-6H,7H2,1-2H3
InChIKeyZHLUULMBLZNAHG-UHFFFAOYSA-N
MW209.68 g/mol
LogP2.14
Rot. Bonds2

About 3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine

3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine (PubChem CID 43478139) has the molecular formula C10H12ClN3 and a molecular weight of 209.68 g/mol. Its IUPAC name is 3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound Name3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine
PubChem CID43478139
Molecular FormulaC10H12ClN3
Molecular Weight209.68 g/mol
Exact Mass209.07
IUPAC Name3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine
SMILESCN(C)c1nc2ccccn2c1CCl
InChIInChI=1S/C10H12ClN3/c1-13(2)10-8(7-11)14-6-4-3-5-9(14)12-10/h3-6H,7H2,1-2H3
InChIKeyZHLUULMBLZNAHG-UHFFFAOYSA-N
XLogP2.14
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.68
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine?
The IUPAC name of 3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine (CID 43478139) is 3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for 3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for 3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine is CN(C)c1nc2ccccn2c1CCl.
What is the InChIKey of 3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine?
The InChIKey is ZHLUULMBLZNAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3/c1-13(2)10-8(7-11)14-6-4-3-5-9(14)12-10/h3-6H,7H2,1-2H3.
What are the key properties of 3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine?
3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine has a molecular weight of 209.68 g/mol, XLogP of 2.14, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(chloromethyl)-N,N-dimethylimidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 43478139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).