5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide

C11H10N4O2 — CID 102790172

IUPAC5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide
SMILESNC(=O)c1noc(-c2ccc3c(c2)NCC3)n1
InChIInChI=1S/C11H10N4O2/c12-9(16)10-14-11(17-15-10)7-2-1-6-3-4-13-8(6)5-7/h1-2,5,13H,3-4H2,(H2,12,16)
InChIKeySDNIUQKVTPECLD-UHFFFAOYSA-N
MW230.23 g/mol
LogP0.80
Rot. Bonds2

About 5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide

5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide (PubChem CID 102790172) has the molecular formula C11H10N4O2 and a molecular weight of 230.23 g/mol. Its IUPAC name is 5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound Name5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide
PubChem CID102790172
Molecular FormulaC11H10N4O2
Molecular Weight230.23 g/mol
Exact Mass230.08
IUPAC Name5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide
SMILESNC(=O)c1noc(-c2ccc3c(c2)NCC3)n1
InChIInChI=1S/C11H10N4O2/c12-9(16)10-14-11(17-15-10)7-2-1-6-3-4-13-8(6)5-7/h1-2,5,13H,3-4H2,(H2,12,16)
InChIKeySDNIUQKVTPECLD-UHFFFAOYSA-N
XLogP0.80
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.23
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2,3-dihydro-1H-indol-6-yl)-3-(trifluoromethyl)-1,2,4-oxadiazole
CID 113382399
3-cyclopropyl-5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole
CID 113382393
5-(2,3-dihydro-1H-inden-5-yl)-1,2,4-oxadiazole-3-carboxylic acid
CID 55184374
5-(1,2,3,4-tetrahydroisoquinolin-5-yl)-1,2,4-oxadiazole-3-carboxamide
CID 102790355
5-(2-amino-1,3-benzothiazol-6-yl)-1,2,4-oxadiazole-3-carboxamide
CID 102790116
5-(2,3-dihydro-1H-indol-5-yl)-3-phenyl-1,2,4-oxadiazole
CID 43325507
5-(2,3-dihydro-1H-indol-5-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole
CID 43622149
6-(4,6-dimethylpyrimidin-5-yl)-2,3-dihydro-1H-indole
CID 59435381
5,7-dichloro-2-(2,3-dihydro-1H-indol-6-yl)-1,3-benzoxazole
CID 107676012
3-(3-bromophenyl)-5-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazole
CID 43325515
5-(2,3-dihydro-1H-indol-5-yl)-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole
CID 63891268
5-(5-cyano-1H-pyrrol-2-yl)-1,2,4-oxadiazole-3-carboxamide
CID 136771154

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of 5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide (CID 102790172) is 5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for 5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for 5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide is NC(=O)c1noc(-c2ccc3c(c2)NCC3)n1.
What is the InChIKey of 5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is SDNIUQKVTPECLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O2/c12-9(16)10-14-11(17-15-10)7-2-1-6-3-4-13-8(6)5-7/h1-2,5,13H,3-4H2,(H2,12,16).
What are the key properties of 5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide?
5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 230.23 g/mol, XLogP of 0.80, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dihydro-1H-indol-6-yl)-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 102790172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).