6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide

C21H16ClN3O2 — CID 142505436

IUPAC6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide
SMILESO=C(NC1Cc2ccccc2C1)c1c(-c2ccc(Cl)cc2)nc2occn12
InChIInChI=1S/C21H16ClN3O2/c22-16-7-5-13(6-8-16)18-19(25-9-10-27-21(25)24-18)20(26)23-17-11-14-3-1-2-4-15(14)12-17/h1-10,17H,11-12H2,(H,23,26)
InChIKeyIEOYLECRSAQGOT-UHFFFAOYSA-N
MW377.83 g/mol
LogP4.14
Rot. Bonds3

About 6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide

6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide (PubChem CID 142505436) has the molecular formula C21H16ClN3O2 and a molecular weight of 377.83 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide.

Molecular Properties

Compound Name6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide
PubChem CID142505436
Molecular FormulaC21H16ClN3O2
Molecular Weight377.83 g/mol
Exact Mass377.09
IUPAC Name6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide
SMILESO=C(NC1Cc2ccccc2C1)c1c(-c2ccc(Cl)cc2)nc2occn12
InChIInChI=1S/C21H16ClN3O2/c22-16-7-5-13(6-8-16)18-19(25-9-10-27-21(25)24-18)20(26)23-17-11-14-3-1-2-4-15(14)12-17/h1-10,17H,11-12H2,(H,23,26)
InChIKeyIEOYLECRSAQGOT-UHFFFAOYSA-N
XLogP4.14
TPSA59.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.83
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide?
The IUPAC name of 6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide (CID 142505436) is 6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide.
What is the SMILES notation for 6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide?
The canonical SMILES for 6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide is O=C(NC1Cc2ccccc2C1)c1c(-c2ccc(Cl)cc2)nc2occn12.
What is the InChIKey of 6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide?
The InChIKey is IEOYLECRSAQGOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16ClN3O2/c22-16-7-5-13(6-8-16)18-19(25-9-10-27-21(25)24-18)20(26)23-17-11-14-3-1-2-4-15(14)12-17/h1-10,17H,11-12H2,(H,23,26).
What are the key properties of 6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide?
6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide has a molecular weight of 377.83 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)imidazo[2,1-b][1,3]oxazole-5-carboxamide is sourced from PubChem (CID 142505436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).