ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate

C14H16N2O2 — CID 118509491

IUPACethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate
SMILESCCOC(=O)C1CC1c1nc2ccccn2c1C
InChIInChI=1S/C14H16N2O2/c1-3-18-14(17)11-8-10(11)13-9(2)16-7-5-4-6-12(16)15-13/h4-7,10-11H,3,8H2,1-2H3
InChIKeyBLXNZZRMLRIJLD-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.31
Rot. Bonds3

About ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate

ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate (PubChem CID 118509491) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate.

Molecular Properties

Compound Nameethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate
PubChem CID118509491
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Nameethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate
SMILESCCOC(=O)C1CC1c1nc2ccccn2c1C
InChIInChI=1S/C14H16N2O2/c1-3-18-14(17)11-8-10(11)13-9(2)16-7-5-4-6-12(16)15-13/h4-7,10-11H,3,8H2,1-2H3
InChIKeyBLXNZZRMLRIJLD-UHFFFAOYSA-N
XLogP2.31
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl (1S)-2-isoquinolin-1-ylcyclopropane-1-carboxylate
CID 90221399
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CID 66837013
cis-ethyl (1S,2R)-2-naphthalen-2-ylcyclopropane-1-carboxylate
CID 15758689
trans-ethyl (1S,2S)-2-(2-bromophenyl)cyclopropane-1-carboxylate
CID 132553582
cis-ethyl (1S,2R)-2-(2-chlorophenyl)cyclopropane-1-carboxylate
CID 86338840
ethyl 2-phenylcyclopropane-1-carboxylate;2-phenylcyclopropane-1-carboxylic acid
CID 70636165
ethyl 2-(2-methyl-1,3-oxazol-4-yl)cyclopropane-1-carboxylate
CID 89415647
ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride
CID 52988808
ethyl 3-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate
CID 67953969
ethyl 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-2-oxoacetate
CID 75480680
2-amino-1-(3-methylimidazo[1,2-a]pyridin-2-yl)ethanone
CID 84661951
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CID 171735423

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate?
The IUPAC name of ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate (CID 118509491) is ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate.
What is the SMILES notation for ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate?
The canonical SMILES for ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate is CCOC(=O)C1CC1c1nc2ccccn2c1C.
What is the InChIKey of ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate?
The InChIKey is BLXNZZRMLRIJLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-3-18-14(17)11-8-10(11)13-9(2)16-7-5-4-6-12(16)15-13/h4-7,10-11H,3,8H2,1-2H3.
What are the key properties of ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate?
ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate has a molecular weight of 244.29 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropane-1-carboxylate is sourced from PubChem (CID 118509491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).