N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide

C15H16N4O2 — CID 102791072

IUPACN-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide
SMILESO=C(NC1CC1)c1noc(CC2CNc3ccccc32)n1
InChIInChI=1S/C15H16N4O2/c20-15(17-10-5-6-10)14-18-13(21-19-14)7-9-8-16-12-4-2-1-3-11(9)12/h1-4,9-10,16H,5-8H2,(H,17,20)
InChIKeyGKQVFPMRIDTHAH-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.71
Rot. Bonds4

About N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide

N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide (PubChem CID 102791072) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide
PubChem CID102791072
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC NameN-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide
SMILESO=C(NC1CC1)c1noc(CC2CNc3ccccc32)n1
InChIInChI=1S/C15H16N4O2/c20-15(17-10-5-6-10)14-18-13(21-19-14)7-9-8-16-12-4-2-1-3-11(9)12/h1-4,9-10,16H,5-8H2,(H,17,20)
InChIKeyGKQVFPMRIDTHAH-UHFFFAOYSA-N
XLogP1.71
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2,3-dihydro-1H-indol-3-ylmethyl)-N-ethyl-1,2,4-oxadiazole-3-carboxamide
CID 102791409
5-(2,3-dihydro-1H-indol-3-ylmethyl)-3-(thiolan-2-yl)-1,2,4-oxadiazole
CID 80620238
5-(2,3-dihydro-1H-indol-3-ylmethyl)-3-pyridin-2-yl-1,2,4-oxadiazole
CID 80575366
1-[5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazol-3-yl]-N,N-dimethylmethanamine
CID 80577248
5-(2,3-dihydro-1H-indol-3-ylmethyl)-3-(methylsulfanylmethyl)-1,2,4-oxadiazole
CID 80577038
5-(2,3-dihydro-1H-indol-3-ylmethyl)-3-(3,3,3-trifluoropropyl)-1,2,4-oxadiazole
CID 80575398
5-(2,3-dihydro-1H-indol-3-ylmethyl)-3-(oxan-3-yl)-1,2,4-oxadiazole
CID 80575396
N-cyclopropyl-5-(1,2,3,4-tetrahydroisoquinolin-4-yl)-1,2,4-oxadiazole-3-carboxamide
CID 102790764
5-(aminooxymethyl)-N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide
CID 102790953
N-cyclohexyl-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573809
N-cyclopentyl-3-(2,3-dihydro-1H-indol-3-yl)propanamide
CID 115105541
5-[(3-chloroanilino)methyl]-N-cyclopropyl-1,2,4-oxadiazole-3-carboxamide
CID 102791051

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide (CID 102791072) is N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide is O=C(NC1CC1)c1noc(CC2CNc3ccccc32)n1.
What is the InChIKey of N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide?
The InChIKey is GKQVFPMRIDTHAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c20-15(17-10-5-6-10)14-18-13(21-19-14)7-9-8-16-12-4-2-1-3-11(9)12/h1-4,9-10,16H,5-8H2,(H,17,20).
What are the key properties of N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide?
N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(2,3-dihydro-1H-indol-3-ylmethyl)-1,2,4-oxadiazole-3-carboxamide is sourced from PubChem (CID 102791072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).