imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate

C20H19ClN2O2 — CID 8759120

IUPACimidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate
SMILESO=C(OCc1cn2ccccc2n1)C1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C20H19ClN2O2/c21-16-8-6-15(7-9-16)20(10-2-3-11-20)19(24)25-14-17-13-23-12-4-1-5-18(23)22-17/h1,4-9,12-13H,2-3,10-11,14H2
InChIKeyBFJKEGCQHCZPMF-UHFFFAOYSA-N
MW354.84 g/mol
LogP4.54
Rot. Bonds4

About imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate

imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate (PubChem CID 8759120) has the molecular formula C20H19ClN2O2 and a molecular weight of 354.84 g/mol. Its IUPAC name is imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate.

Molecular Properties

Compound Nameimidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate
PubChem CID8759120
Molecular FormulaC20H19ClN2O2
Molecular Weight354.84 g/mol
Exact Mass354.11
IUPAC Nameimidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate
SMILESO=C(OCc1cn2ccccc2n1)C1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C20H19ClN2O2/c21-16-8-6-15(7-9-16)20(10-2-3-11-20)19(24)25-14-17-13-23-12-4-1-5-18(23)22-17/h1,4-9,12-13H,2-3,10-11,14H2
InChIKeyBFJKEGCQHCZPMF-UHFFFAOYSA-N
XLogP4.54
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.84
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate?
The IUPAC name of imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate (CID 8759120) is imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate.
What is the SMILES notation for imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate?
The canonical SMILES for imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate is O=C(OCc1cn2ccccc2n1)C1(c2ccc(Cl)cc2)CCCC1.
What is the InChIKey of imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate?
The InChIKey is BFJKEGCQHCZPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN2O2/c21-16-8-6-15(7-9-16)20(10-2-3-11-20)19(24)25-14-17-13-23-12-4-1-5-18(23)22-17/h1,4-9,12-13H,2-3,10-11,14H2.
What are the key properties of imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate?
imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate has a molecular weight of 354.84 g/mol, XLogP of 4.54, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyridin-2-ylmethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate is sourced from PubChem (CID 8759120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).