2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide

C17H16N4O3 — CID 139412361

IUPAC2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide
SMILESCc1nc(-c2ccc3c(c2)CC[C@H]3NC(=O)c2cnc(C)o2)no1
InChIInChI=1S/C17H16N4O3/c1-9-18-8-15(23-9)17(22)20-14-6-4-11-7-12(3-5-13(11)14)16-19-10(2)24-21-16/h3,5,7-8,14H,4,6H2,1-2H3,(H,20,22)/t14-/m1/s1
InChIKeyHBXBXTVOBLYVRD-CQSZACIVSA-N
MW324.34 g/mol
LogP2.76
Rot. Bonds3

About 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide

2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide (PubChem CID 139412361) has the molecular formula C17H16N4O3 and a molecular weight of 324.34 g/mol. Its IUPAC name is 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide
PubChem CID139412361
Molecular FormulaC17H16N4O3
Molecular Weight324.34 g/mol
Exact Mass324.12
IUPAC Name2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide
SMILESCc1nc(-c2ccc3c(c2)CC[C@H]3NC(=O)c2cnc(C)o2)no1
InChIInChI=1S/C17H16N4O3/c1-9-18-8-15(23-9)17(22)20-14-6-4-11-7-12(3-5-13(11)14)16-19-10(2)24-21-16/h3,5,7-8,14H,4,6H2,1-2H3,(H,20,22)/t14-/m1/s1
InChIKeyHBXBXTVOBLYVRD-CQSZACIVSA-N
XLogP2.76
TPSA94.05 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide?
The IUPAC name of 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide (CID 139412361) is 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide.
What is the SMILES notation for 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide?
The canonical SMILES for 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide is Cc1nc(-c2ccc3c(c2)CC[C@H]3NC(=O)c2cnc(C)o2)no1.
What is the InChIKey of 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide?
The InChIKey is HBXBXTVOBLYVRD-CQSZACIVSA-N. The full InChI is InChI=1S/C17H16N4O3/c1-9-18-8-15(23-9)17(22)20-14-6-4-11-7-12(3-5-13(11)14)16-19-10(2)24-21-16/h3,5,7-8,14H,4,6H2,1-2H3,(H,20,22)/t14-/m1/s1.
What are the key properties of 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide?
2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide has a molecular weight of 324.34 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1R)-5-(5-methyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl]-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 139412361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).