N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide

C7H9N3O2 — CID 103670407

IUPACN-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide
SMILESO=C(NCc1ncon1)C1CC1
InChIInChI=1S/C7H9N3O2/c11-7(5-1-2-5)8-3-6-9-4-12-10-6/h4-5H,1-3H2,(H,8,11)
InChIKeyTUXOGGBQJGYXSB-UHFFFAOYSA-N
MW167.17 g/mol
LogP0.10
Rot. Bonds3

About N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide

N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide (PubChem CID 103670407) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide
PubChem CID103670407
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC NameN-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide
SMILESO=C(NCc1ncon1)C1CC1
InChIInChI=1S/C7H9N3O2/c11-7(5-1-2-5)8-3-6-9-4-12-10-6/h4-5H,1-3H2,(H,8,11)
InChIKeyTUXOGGBQJGYXSB-UHFFFAOYSA-N
XLogP0.10
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide?
The IUPAC name of N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide (CID 103670407) is N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide?
The canonical SMILES for N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide is O=C(NCc1ncon1)C1CC1.
What is the InChIKey of N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide?
The InChIKey is TUXOGGBQJGYXSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c11-7(5-1-2-5)8-3-6-9-4-12-10-6/h4-5H,1-3H2,(H,8,11).
What are the key properties of N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide?
N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide has a molecular weight of 167.17 g/mol, XLogP of 0.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,4-oxadiazol-3-ylmethyl)cyclopropanecarboxamide is sourced from PubChem (CID 103670407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).