3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol

C13H15ClN2O — CID 81415131

IUPAC3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol
SMILESCC1(C)C(O)CC1c1c(Cl)nc2ccccn12
InChIInChI=1S/C13H15ClN2O/c1-13(2)8(7-9(13)17)11-12(14)15-10-5-3-4-6-16(10)11/h3-6,8-9,17H,7H2,1-2H3
InChIKeyKKZLMHLIWKFXHP-UHFFFAOYSA-N
MW250.73 g/mol
LogP2.86
Rot. Bonds1

About 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol

3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol (PubChem CID 81415131) has the molecular formula C13H15ClN2O and a molecular weight of 250.73 g/mol. Its IUPAC name is 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol.

Molecular Properties

Compound Name3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol
PubChem CID81415131
Molecular FormulaC13H15ClN2O
Molecular Weight250.73 g/mol
Exact Mass250.09
IUPAC Name3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol
SMILESCC1(C)C(O)CC1c1c(Cl)nc2ccccn12
InChIInChI=1S/C13H15ClN2O/c1-13(2)8(7-9(13)17)11-12(14)15-10-5-3-4-6-16(10)11/h3-6,8-9,17H,7H2,1-2H3
InChIKeyKKZLMHLIWKFXHP-UHFFFAOYSA-N
XLogP2.86
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2-methylcyclobutan-1-ol
CID 81416434
2,3-dichloropyrido[1,2-a]pyrimidin-4-one
CID 74890119
2-chloro-3-(4,4-dimethylpiperidin-1-yl)sulfonylimidazo[1,2-a]pyridine
CID 62924166
ethyl 3-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate
CID 67953969
3-[[(2-chloroimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]cyclohexan-1-ol
CID 111467503
2,2-dimethyl-3-[2-(trifluoromethoxy)phenyl]cyclobutan-1-ol
CID 81415007
2-bromoiodanuidyl-3-cyclopropylimidazo[1,2-a]pyridine
CID 178182334
3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine
CID 166210907
3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2-methylprop-2-en-1-amine
CID 79329142
N-[3-(2-chloroimidazo[1,2-a]pyridin-3-yl)prop-2-enyl]cyclopropanamine
CID 79347604
2-chloroimidazo[1,2-a]pyridine-3-sulfonamide
CID 14422354
2-chloro-N-[(3-hydroxycyclohexyl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 111460280

Frequently Asked Questions

What is the IUPAC name of 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol?
The IUPAC name of 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol (CID 81415131) is 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol.
What is the SMILES notation for 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol?
The canonical SMILES for 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol is CC1(C)C(O)CC1c1c(Cl)nc2ccccn12.
What is the InChIKey of 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol?
The InChIKey is KKZLMHLIWKFXHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O/c1-13(2)8(7-9(13)17)11-12(14)15-10-5-3-4-6-16(10)11/h3-6,8-9,17H,7H2,1-2H3.
What are the key properties of 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol?
3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol has a molecular weight of 250.73 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol is sourced from PubChem (CID 81415131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).