N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide

C22H22N2O2 — CID 24598370

IUPACN-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
SMILESCc1ccc(-c2cnc(CCC(=O)NC3CCc4ccccc43)o2)cc1
InChIInChI=1S/C22H22N2O2/c1-15-6-8-17(9-7-15)20-14-23-22(26-20)13-12-21(25)24-19-11-10-16-4-2-3-5-18(16)19/h2-9,14,19H,10-13H2,1H3,(H,24,25)
InChIKeyGLULZTCJOSTOAS-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.39
Rot. Bonds5

About N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide

N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide (PubChem CID 24598370) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
PubChem CID24598370
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
SMILESCc1ccc(-c2cnc(CCC(=O)NC3CCc4ccccc43)o2)cc1
InChIInChI=1S/C22H22N2O2/c1-15-6-8-17(9-7-15)20-14-23-22(26-20)13-12-21(25)24-19-11-10-16-4-2-3-5-18(16)19/h2-9,14,19H,10-13H2,1H3,(H,24,25)
InChIKeyGLULZTCJOSTOAS-UHFFFAOYSA-N
XLogP4.39
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide (CID 24598370) is N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide is Cc1ccc(-c2cnc(CCC(=O)NC3CCc4ccccc43)o2)cc1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide?
The InChIKey is GLULZTCJOSTOAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-15-6-8-17(9-7-15)20-14-23-22(26-20)13-12-21(25)24-19-11-10-16-4-2-3-5-18(16)19/h2-9,14,19H,10-13H2,1H3,(H,24,25).
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide?
N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide has a molecular weight of 346.43 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide is sourced from PubChem (CID 24598370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).