3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine

C10H11ClN2 — CID 39146618

IUPAC3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine
SMILESCc1ccc2ncc([C@@H](C)Cl)n2c1
InChIInChI=1S/C10H11ClN2/c1-7-3-4-10-12-5-9(8(2)11)13(10)6-7/h3-6,8H,1-2H3/t8-/m1/s1
InChIKeyWOBFRZRFXUKXIW-MRVPVSSYSA-N
MW194.66 g/mol
LogP2.94
Rot. Bonds1

About 3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine

3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine (PubChem CID 39146618) has the molecular formula C10H11ClN2 and a molecular weight of 194.66 g/mol. Its IUPAC name is 3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine
PubChem CID39146618
Molecular FormulaC10H11ClN2
Molecular Weight194.66 g/mol
Exact Mass194.06
IUPAC Name3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine
SMILESCc1ccc2ncc([C@@H](C)Cl)n2c1
InChIInChI=1S/C10H11ClN2/c1-7-3-4-10-12-5-9(8(2)11)13(10)6-7/h3-6,8H,1-2H3/t8-/m1/s1
InChIKeyWOBFRZRFXUKXIW-MRVPVSSYSA-N
XLogP2.94
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.66
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine?
The IUPAC name of 3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine (CID 39146618) is 3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine is Cc1ccc2ncc([C@@H](C)Cl)n2c1.
What is the InChIKey of 3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine?
The InChIKey is WOBFRZRFXUKXIW-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H11ClN2/c1-7-3-4-10-12-5-9(8(2)11)13(10)6-7/h3-6,8H,1-2H3/t8-/m1/s1.
What are the key properties of 3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine?
3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine has a molecular weight of 194.66 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1R)-1-chloroethyl]-6-methylimidazo[1,2-a]pyridine is sourced from PubChem (CID 39146618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).