6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine

C12H13ClN2O — CID 117129074

IUPAC6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine
SMILESClc1ccc2nc(CC3CCOC3)cn2c1
InChIInChI=1S/C12H13ClN2O/c13-10-1-2-12-14-11(7-15(12)6-10)5-9-3-4-16-8-9/h1-2,6-7,9H,3-5,8H2
InChIKeyLLXRDDKAEWHFLX-UHFFFAOYSA-N
MW236.70 g/mol
LogP2.57
Rot. Bonds2

About 6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine

6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine (PubChem CID 117129074) has the molecular formula C12H13ClN2O and a molecular weight of 236.70 g/mol. Its IUPAC name is 6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine
PubChem CID117129074
Molecular FormulaC12H13ClN2O
Molecular Weight236.70 g/mol
Exact Mass236.07
IUPAC Name6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine
SMILESClc1ccc2nc(CC3CCOC3)cn2c1
InChIInChI=1S/C12H13ClN2O/c13-10-1-2-12-14-11(7-15(12)6-10)5-9-3-4-16-8-9/h1-2,6-7,9H,3-5,8H2
InChIKeyLLXRDDKAEWHFLX-UHFFFAOYSA-N
XLogP2.57
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.70
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(3R)-oxolan-3-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 163213817
6-chloro-2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117129093
7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117134668
8-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136059
2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine-7-carbaldehyde
CID 117133746
6-chloro-2-(oxan-4-yl)imidazo[1,2-a]pyridine
CID 117128940
8-bromo-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136060
7-methyl-2-(oxan-4-ylmethyl)imidazo[1,2-a]pyridine
CID 117133889
2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl-(oxan-4-yl)amino]acetamide
CID 167944913
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-cyclopropylpropan-1-amine
CID 115639536
8-chloro-2-(oxan-4-ylmethyl)imidazo[1,2-a]pyridine
CID 117136187
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]cyclohexanamine
CID 78912632

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine (CID 117129074) is 6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine is Clc1ccc2nc(CC3CCOC3)cn2c1.
What is the InChIKey of 6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is LLXRDDKAEWHFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2O/c13-10-1-2-12-14-11(7-15(12)6-10)5-9-3-4-16-8-9/h1-2,6-7,9H,3-5,8H2.
What are the key properties of 6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine?
6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 236.70 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 117129074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).